void register_FEP_class(){
{ //::SireAnalysis::FEP
typedef bp::class_< SireAnalysis::FEP, bp::bases< SireBase::Property > > FEP_exposer_t;
FEP_exposer_t FEP_exposer = FEP_exposer_t( "FEP", "This class is used to analyse the free energies that are\ncalculated during a free energy perturbation (FEP) simulation\n\nAuthor: Christopher Woods\n", bp::init< >("Constructor") );
bp::scope FEP_scope( FEP_exposer );
FEP_exposer.def( bp::init< QList< double > const &, QMap< double, SireMaths::FreeEnergyAverage > const & >(( bp::arg("windows"), bp::arg("deltas") ), "Construct to use the passed set of windows, with the free energy deltas from\neach window to the window above") );
FEP_exposer.def( bp::init< QList< double > const &, QMap< double, SireMaths::FreeEnergyAverage > const &, QMap< double, SireMaths::FreeEnergyAverage > const & >(( bp::arg("windows"), bp::arg("forwards_deltas"), bp::arg("backwards_deltas") ), "Construct to use the passed windows, with the free energy deltas from\neach window to the window above in forwards_deltas and from the window\nbelow to each window in backwards_deltas") );
FEP_exposer.def( bp::init< SireAnalysis::FEPDeltas const & >(( bp::arg("deltas") ), "Construct to use the passed FEP deltas") );
FEP_exposer.def( bp::init< SireAnalysis::FEP const & >(( bp::arg("other") ), "Copy constructor") );
{ //::SireAnalysis::FEP::add
typedef void ( ::SireAnalysis::FEP::*add_function_type)( ::QList< double > const &,::QMap< double, SireMaths::FreeEnergyAverage > const & ) ;
add_function_type add_function_value( &::SireAnalysis::FEP::add );
FEP_exposer.def(
"add"
, add_function_value
, ( bp::arg("windows"), bp::arg("deltas") )
, "Add the data for the next iteration, which contains the deltas for the passed windows,\nwith the free energy being for each window to the next window" );
}
{ //::SireAnalysis::FEP::add
typedef void ( ::SireAnalysis::FEP::*add_function_type)( ::QList< double > const &,::QMap< double, SireMaths::FreeEnergyAverage > const &,::QMap< double, SireMaths::FreeEnergyAverage > const & ) ;
add_function_type add_function_value( &::SireAnalysis::FEP::add );
FEP_exposer.def(
"add"
, add_function_value
, ( bp::arg("windows"), bp::arg("forwards_deltas"), bp::arg("backwards_deltas") )
, "Add the data for the next iteration, which contains the deltas for the passed windows,\nwith forwards_deltas containing the free energy from each window to the next window,\nand backwards_deltas containing the free energy from the previous window to each window" );
}
{ //::SireAnalysis::FEP::add
typedef void ( ::SireAnalysis::FEP::*add_function_type)( ::SireAnalysis::FEPDeltas const & ) ;
add_function_type add_function_value( &::SireAnalysis::FEP::add );
FEP_exposer.def(
"add"
, add_function_value
, ( bp::arg("deltas") )
, "Add the data for the next iteration" );
}
{ //::SireAnalysis::FEP::at
typedef ::SireAnalysis::FEPDeltas ( ::SireAnalysis::FEP::*at_function_type)( int ) const;
at_function_type at_function_value( &::SireAnalysis::FEP::at );
FEP_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, "Return the deltas for the ith iteration" );
}
{ //::SireAnalysis::FEP::clear
typedef void ( ::SireAnalysis::FEP::*clear_function_type)( ) ;
clear_function_type clear_function_value( &::SireAnalysis::FEP::clear );
FEP_exposer.def(
"clear"
, clear_function_value
, "Remove all values from the histogram" );
}
{ //::SireAnalysis::FEP::count
typedef int ( ::SireAnalysis::FEP::*count_function_type)( ) const;
count_function_type count_function_value( &::SireAnalysis::FEP::count );
FEP_exposer.def(
"count"
, count_function_value
, "Return the number of iterations" );
}
{ //::SireAnalysis::FEP::deltas
typedef ::QList< SireAnalysis::FEPDeltas > ( ::SireAnalysis::FEP::*deltas_function_type)( ) const;
deltas_function_type deltas_function_value( &::SireAnalysis::FEP::deltas );
FEP_exposer.def(
"deltas"
, deltas_function_value
, "Return the deltas for all iterations" );
}
{ //::SireAnalysis::FEP::lambdaValues
typedef ::QList< double > ( ::SireAnalysis::FEP::*lambdaValues_function_type)( ) const;
lambdaValues_function_type lambdaValues_function_value( &::SireAnalysis::FEP::lambdaValues );
FEP_exposer.def(
"lambdaValues"
, lambdaValues_function_value
, "Return the values of all windows" );
}
{ //::SireAnalysis::FEP::merge
typedef ::SireAnalysis::FEPDeltas ( ::SireAnalysis::FEP::*merge_function_type)( int,int ) const;
merge_function_type merge_function_value( &::SireAnalysis::FEP::merge );
FEP_exposer.def(
"merge"
, merge_function_value
, ( bp::arg("start"), bp::arg("end") )
, "Merge the deltas for iterations start->end" );
}
{ //::SireAnalysis::FEP::merge
typedef ::SireAnalysis::FEPDeltas ( ::SireAnalysis::FEP::*merge_function_type)( ::QList< int > ) const;
merge_function_type merge_function_value( &::SireAnalysis::FEP::merge );
FEP_exposer.def(
"merge"
, merge_function_value
, ( bp::arg("indicies") )
, "Merge the deltas at the passed indicies" );
}
{ //::SireAnalysis::FEP::nIterations
typedef int ( ::SireAnalysis::FEP::*nIterations_function_type)( ) const;
nIterations_function_type nIterations_function_value( &::SireAnalysis::FEP::nIterations );
FEP_exposer.def(
"nIterations"
, nIterations_function_value
, "Return the number of iterations" );
}
{ //::SireAnalysis::FEP::nLambdaValues
typedef int ( ::SireAnalysis::FEP::*nLambdaValues_function_type)( ) const;
nLambdaValues_function_type nLambdaValues_function_value( &::SireAnalysis::FEP::nLambdaValues );
FEP_exposer.def(
"nLambdaValues"
, nLambdaValues_function_value
, "Return the number of lambda values (windows)" );
}
{ //::SireAnalysis::FEP::nSamples
typedef ::qint64 ( ::SireAnalysis::FEP::*nSamples_function_type)( ) const;
nSamples_function_type nSamples_function_value( &::SireAnalysis::FEP::nSamples );
FEP_exposer.def(
"nSamples"
, nSamples_function_value
, "Return the total number of samples in the simulation" );
}
{ //::SireAnalysis::FEP::nWindows
typedef int ( ::SireAnalysis::FEP::*nWindows_function_type)( ) const;
nWindows_function_type nWindows_function_value( &::SireAnalysis::FEP::nWindows );
FEP_exposer.def(
"nWindows"
, nWindows_function_value
, "Return the number of windows" );
}
FEP_exposer.def( bp::self != bp::self );
{ //::SireAnalysis::FEP::operator=
typedef ::SireAnalysis::FEP & ( ::SireAnalysis::FEP::*assign_function_type)( ::SireAnalysis::FEP const & ) ;
assign_function_type assign_function_value( &::SireAnalysis::FEP::operator= );
FEP_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >()
, "" );
}
FEP_exposer.def( bp::self == bp::self );
{ //::SireAnalysis::FEP::operator[]
typedef ::SireAnalysis::FEPDeltas ( ::SireAnalysis::FEP::*__getitem___function_type)( int ) const;
__getitem___function_type __getitem___function_value( &::SireAnalysis::FEP::operator[] );
FEP_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, "" );
}
{ //::SireAnalysis::FEP::removeAt
typedef void ( ::SireAnalysis::FEP::*removeAt_function_type)( int ) ;
removeAt_function_type removeAt_function_value( &::SireAnalysis::FEP::removeAt );
FEP_exposer.def(
"removeAt"
, removeAt_function_value
, ( bp::arg("i") )
, "Remove the data for iteration i" );
}
{ //::SireAnalysis::FEP::removeRange
typedef void ( ::SireAnalysis::FEP::*removeRange_function_type)( int,int ) ;
removeRange_function_type removeRange_function_value( &::SireAnalysis::FEP::removeRange );
FEP_exposer.def(
"removeRange"
, removeRange_function_value
, ( bp::arg("start"), bp::arg("end") )
, "Remove every iteration from start to end (inclusively)" );
}
{ //::SireAnalysis::FEP::rollingAverage
typedef ::QList< SireAnalysis::FEPDeltas > ( ::SireAnalysis::FEP::*rollingAverage_function_type)( int ) const;
rollingAverage_function_type rollingAverage_function_value( &::SireAnalysis::FEP::rollingAverage );
FEP_exposer.def(
"rollingAverage"
, rollingAverage_function_value
, ( bp::arg("niterations") )
, "Return a list of Gradients that represents the rolling average over niterations\niterations over this TI data set. If this data set contains 100 iterations, and\nwe calculate the rolling average over 50 iterations, then the returned Gradients\nwill be the average from 1-50, then 2-51, 3-52.....51-100" );
}
{ //::SireAnalysis::FEP::set
typedef void ( ::SireAnalysis::FEP::*set_function_type)( int,::QList< double > const &,::QMap< double, SireMaths::FreeEnergyAverage > const & ) ;
set_function_type set_function_value( &::SireAnalysis::FEP::set );
FEP_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("windows"), bp::arg("deltas") )
, "Set the deltas for the ith iteration" );
}
{ //::SireAnalysis::FEP::set
typedef void ( ::SireAnalysis::FEP::*set_function_type)( int,::QList< double > const &,::QMap< double, SireMaths::FreeEnergyAverage > const &,::QMap< double, SireMaths::FreeEnergyAverage > const & ) ;
set_function_type set_function_value( &::SireAnalysis::FEP::set );
FEP_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("windows"), bp::arg("forwards_deltas"), bp::arg("backwards_deltas") )
, "Set the deltas for the ith iteration" );
}
{ //::SireAnalysis::FEP::set
typedef void ( ::SireAnalysis::FEP::*set_function_type)( int,::SireAnalysis::FEPDeltas const & ) ;
set_function_type set_function_value( &::SireAnalysis::FEP::set );
FEP_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("deltas") )
, "Set the deltas for the ith iteration" );
}
{ //::SireAnalysis::FEP::size
typedef int ( ::SireAnalysis::FEP::*size_function_type)( ) const;
size_function_type size_function_value( &::SireAnalysis::FEP::size );
FEP_exposer.def(
"size"
, size_function_value
, "Return the number of iterations" );
}
{ //::SireAnalysis::FEP::toString
typedef ::QString ( ::SireAnalysis::FEP::*toString_function_type)( ) const;
toString_function_type toString_function_value( &::SireAnalysis::FEP::toString );
FEP_exposer.def(
"toString"
, toString_function_value
, "" );
}
{ //::SireAnalysis::FEP::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireAnalysis::FEP::typeName );
FEP_exposer.def(
"typeName"
, typeName_function_value
, "" );
}
{ //::SireAnalysis::FEP::what
typedef char const * ( ::SireAnalysis::FEP::*what_function_type)( ) const;
what_function_type what_function_value( &::SireAnalysis::FEP::what );
FEP_exposer.def(
"what"
, what_function_value
, "" );
}
{ //::SireAnalysis::FEP::windows
typedef ::QList< double > ( ::SireAnalysis::FEP::*windows_function_type)( ) const;
windows_function_type windows_function_value( &::SireAnalysis::FEP::windows );
FEP_exposer.def(
"windows"
, windows_function_value
, "Return the value of all windows" );
}
FEP_exposer.staticmethod( "typeName" );
FEP_exposer.def( "__copy__", &__copy__);
FEP_exposer.def( "__deepcopy__", &__copy__);
FEP_exposer.def( "clone", &__copy__);
FEP_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireAnalysis::FEP >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
FEP_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireAnalysis::FEP >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
FEP_exposer.def( "__str__", &__str__< ::SireAnalysis::FEP > );
FEP_exposer.def( "__repr__", &__str__< ::SireAnalysis::FEP > );
FEP_exposer.def( "__len__", &__len_size< ::SireAnalysis::FEP > );
}
}
void register_Replicas_class(){
{ //::SireMove::Replicas
typedef bp::class_< SireMove::Replicas, bp::bases< SireMove::SupraSystem, SireBase::Property > > Replicas_exposer_t;
Replicas_exposer_t Replicas_exposer = Replicas_exposer_t( "Replicas", bp::init< >() );
bp::scope Replicas_scope( Replicas_exposer );
Replicas_exposer.def( bp::init< int >(( bp::arg("n") )) );
Replicas_exposer.def( bp::init< SireSystem::System const &, bp::optional< int > >(( bp::arg("system"), bp::arg("n")=(int)(1) )) );
Replicas_exposer.def( bp::init< QVector< SireSystem::System > const & >(( bp::arg("systems") )) );
Replicas_exposer.def( bp::init< SireMove::SupraSubSystem const &, bp::optional< int > >(( bp::arg("subsystem"), bp::arg("n")=(int)(1) )) );
Replicas_exposer.def( bp::init< SireMove::SupraSystem const & >(( bp::arg("suprasystem") )) );
Replicas_exposer.def( bp::init< SireMove::Replicas const & >(( bp::arg("other") )) );
{ //::SireMove::Replicas::at
typedef ::SireMove::Replica const & ( ::SireMove::Replicas::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireMove::Replicas::at );
Replicas_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMove::Replicas::collectSupraStats
typedef void ( ::SireMove::Replicas::*collectSupraStats_function_type )( ) ;
collectSupraStats_function_type collectSupraStats_function_value( &::SireMove::Replicas::collectSupraStats );
Replicas_exposer.def(
"collectSupraStats"
, collectSupraStats_function_value );
}
{ //::SireMove::Replicas::lambdaTrajectory
typedef ::QVector< double > ( ::SireMove::Replicas::*lambdaTrajectory_function_type )( ) const;
lambdaTrajectory_function_type lambdaTrajectory_function_value( &::SireMove::Replicas::lambdaTrajectory );
Replicas_exposer.def(
"lambdaTrajectory"
, lambdaTrajectory_function_value );
}
{ //::SireMove::Replicas::lambdaTrajectoryHistory
typedef ::QList< QVector< double > > ( ::SireMove::Replicas::*lambdaTrajectoryHistory_function_type )( ) const;
lambdaTrajectoryHistory_function_type lambdaTrajectoryHistory_function_value( &::SireMove::Replicas::lambdaTrajectoryHistory );
Replicas_exposer.def(
"lambdaTrajectoryHistory"
, lambdaTrajectoryHistory_function_value );
}
{ //::SireMove::Replicas::nReplicas
typedef int ( ::SireMove::Replicas::*nReplicas_function_type )( ) const;
nReplicas_function_type nReplicas_function_value( &::SireMove::Replicas::nReplicas );
Replicas_exposer.def(
"nReplicas"
, nReplicas_function_value );
}
Replicas_exposer.def( bp::self != bp::self );
{ //::SireMove::Replicas::operator=
typedef ::SireMove::Replicas & ( ::SireMove::Replicas::*assign_function_type )( ::SireMove::Replicas const & ) ;
assign_function_type assign_function_value( &::SireMove::Replicas::operator= );
Replicas_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
Replicas_exposer.def( bp::self == bp::self );
{ //::SireMove::Replicas::operator[]
typedef ::SireMove::Replica const & ( ::SireMove::Replicas::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireMove::Replicas::operator[] );
Replicas_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMove::Replicas::replicaIDs
typedef ::QVector< unsigned int > const & ( ::SireMove::Replicas::*replicaIDs_function_type )( ) const;
replicaIDs_function_type replicaIDs_function_value( &::SireMove::Replicas::replicaIDs );
Replicas_exposer.def(
"replicaIDs"
, replicaIDs_function_value
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMove::Replicas::resetReplicaIDs
typedef void ( ::SireMove::Replicas::*resetReplicaIDs_function_type )( ) ;
resetReplicaIDs_function_type resetReplicaIDs_function_value( &::SireMove::Replicas::resetReplicaIDs );
Replicas_exposer.def(
"resetReplicaIDs"
, resetReplicaIDs_function_value );
}
{ //::SireMove::Replicas::setChemicalPotential
typedef void ( ::SireMove::Replicas::*setChemicalPotential_function_type )( ::SireUnits::Dimension::MolarEnergy const & ) ;
setChemicalPotential_function_type setChemicalPotential_function_value( &::SireMove::Replicas::setChemicalPotential );
Replicas_exposer.def(
"setChemicalPotential"
, setChemicalPotential_function_value
, ( bp::arg("chemical_potential") ) );
}
{ //::SireMove::Replicas::setChemicalPotential
typedef void ( ::SireMove::Replicas::*setChemicalPotential_function_type )( int,::SireUnits::Dimension::MolarEnergy const & ) ;
setChemicalPotential_function_type setChemicalPotential_function_value( &::SireMove::Replicas::setChemicalPotential );
Replicas_exposer.def(
"setChemicalPotential"
, setChemicalPotential_function_value
, ( bp::arg("i"), bp::arg("chemical_potential") ) );
}
{ //::SireMove::Replicas::setEnergyComponent
typedef void ( ::SireMove::Replicas::*setEnergyComponent_function_type )( ::SireCAS::Symbol const & ) ;
setEnergyComponent_function_type setEnergyComponent_function_value( &::SireMove::Replicas::setEnergyComponent );
Replicas_exposer.def(
"setEnergyComponent"
, setEnergyComponent_function_value
, ( bp::arg("symbol") ) );
}
{ //::SireMove::Replicas::setEnergyComponent
typedef void ( ::SireMove::Replicas::*setEnergyComponent_function_type )( int,::SireCAS::Symbol const & ) ;
setEnergyComponent_function_type setEnergyComponent_function_value( &::SireMove::Replicas::setEnergyComponent );
Replicas_exposer.def(
"setEnergyComponent"
, setEnergyComponent_function_value
, ( bp::arg("i"), bp::arg("symbol") ) );
}
{ //::SireMove::Replicas::setFugacity
typedef void ( ::SireMove::Replicas::*setFugacity_function_type )( ::SireUnits::Dimension::Pressure const & ) ;
setFugacity_function_type setFugacity_function_value( &::SireMove::Replicas::setFugacity );
Replicas_exposer.def(
"setFugacity"
, setFugacity_function_value
, ( bp::arg("fugacity") ) );
}
{ //::SireMove::Replicas::setFugacity
typedef void ( ::SireMove::Replicas::*setFugacity_function_type )( int,::SireUnits::Dimension::Pressure const & ) ;
setFugacity_function_type setFugacity_function_value( &::SireMove::Replicas::setFugacity );
Replicas_exposer.def(
"setFugacity"
, setFugacity_function_value
, ( bp::arg("i"), bp::arg("fugacity") ) );
}
{ //::SireMove::Replicas::setGenerator
typedef void ( ::SireMove::Replicas::*setGenerator_function_type )( ::SireMaths::RanGenerator const & ) ;
setGenerator_function_type setGenerator_function_value( &::SireMove::Replicas::setGenerator );
Replicas_exposer.def(
"setGenerator"
, setGenerator_function_value
, ( bp::arg("rangenerator") ) );
}
{ //::SireMove::Replicas::setGenerator
typedef void ( ::SireMove::Replicas::*setGenerator_function_type )( int,::SireMaths::RanGenerator const & ) ;
setGenerator_function_type setGenerator_function_value( &::SireMove::Replicas::setGenerator );
Replicas_exposer.def(
"setGenerator"
, setGenerator_function_value
, ( bp::arg("i"), bp::arg("rangenerator") ) );
}
{ //::SireMove::Replicas::setLambdaComponent
typedef void ( ::SireMove::Replicas::*setLambdaComponent_function_type )( ::SireCAS::Symbol const & ) ;
setLambdaComponent_function_type setLambdaComponent_function_value( &::SireMove::Replicas::setLambdaComponent );
Replicas_exposer.def(
"setLambdaComponent"
, setLambdaComponent_function_value
, ( bp::arg("symbol") ) );
}
{ //::SireMove::Replicas::setLambdaComponent
typedef void ( ::SireMove::Replicas::*setLambdaComponent_function_type )( int,::SireCAS::Symbol const & ) ;
setLambdaComponent_function_type setLambdaComponent_function_value( &::SireMove::Replicas::setLambdaComponent );
Replicas_exposer.def(
"setLambdaComponent"
, setLambdaComponent_function_value
, ( bp::arg("i"), bp::arg("symbol") ) );
}
{ //::SireMove::Replicas::setLambdaValue
typedef void ( ::SireMove::Replicas::*setLambdaValue_function_type )( double ) ;
setLambdaValue_function_type setLambdaValue_function_value( &::SireMove::Replicas::setLambdaValue );
Replicas_exposer.def(
"setLambdaValue"
, setLambdaValue_function_value
, ( bp::arg("value") ) );
}
{ //::SireMove::Replicas::setLambdaValue
typedef void ( ::SireMove::Replicas::*setLambdaValue_function_type )( int,double ) ;
setLambdaValue_function_type setLambdaValue_function_value( &::SireMove::Replicas::setLambdaValue );
Replicas_exposer.def(
"setLambdaValue"
, setLambdaValue_function_value
, ( bp::arg("i"), bp::arg("value") ) );
}
{ //::SireMove::Replicas::setPressure
typedef void ( ::SireMove::Replicas::*setPressure_function_type )( ::SireUnits::Dimension::Pressure const & ) ;
setPressure_function_type setPressure_function_value( &::SireMove::Replicas::setPressure );
Replicas_exposer.def(
"setPressure"
, setPressure_function_value
, ( bp::arg("pressure") ) );
}
{ //::SireMove::Replicas::setPressure
typedef void ( ::SireMove::Replicas::*setPressure_function_type )( int,::SireUnits::Dimension::Pressure const & ) ;
setPressure_function_type setPressure_function_value( &::SireMove::Replicas::setPressure );
Replicas_exposer.def(
"setPressure"
, setPressure_function_value
, ( bp::arg("i"), bp::arg("pressure") ) );
}
{ //::SireMove::Replicas::setReplica
typedef void ( ::SireMove::Replicas::*setReplica_function_type )( ::SireMove::Replica const & ) ;
setReplica_function_type setReplica_function_value( &::SireMove::Replicas::setReplica );
Replicas_exposer.def(
"setReplica"
, setReplica_function_value
, ( bp::arg("replica") ) );
}
{ //::SireMove::Replicas::setReplica
typedef void ( ::SireMove::Replicas::*setReplica_function_type )( int,::SireMove::Replica const & ) ;
setReplica_function_type setReplica_function_value( &::SireMove::Replicas::setReplica );
Replicas_exposer.def(
"setReplica"
, setReplica_function_value
, ( bp::arg("i"), bp::arg("replica") ) );
}
{ //::SireMove::Replicas::setReplicas
typedef void ( ::SireMove::Replicas::*setReplicas_function_type )( ::SireMove::Replicas const & ) ;
setReplicas_function_type setReplicas_function_value( &::SireMove::Replicas::setReplicas );
Replicas_exposer.def(
"setReplicas"
, setReplicas_function_value
, ( bp::arg("replicas") ) );
}
{ //::SireMove::Replicas::setSpaceProperty
typedef void ( ::SireMove::Replicas::*setSpaceProperty_function_type )( ::SireBase::PropertyName const & ) ;
setSpaceProperty_function_type setSpaceProperty_function_value( &::SireMove::Replicas::setSpaceProperty );
Replicas_exposer.def(
"setSpaceProperty"
, setSpaceProperty_function_value
, ( bp::arg("spaceproperty") ) );
}
{ //::SireMove::Replicas::setSpaceProperty
typedef void ( ::SireMove::Replicas::*setSpaceProperty_function_type )( int,::SireBase::PropertyName const & ) ;
setSpaceProperty_function_type setSpaceProperty_function_value( &::SireMove::Replicas::setSpaceProperty );
Replicas_exposer.def(
"setSpaceProperty"
, setSpaceProperty_function_value
, ( bp::arg("i"), bp::arg("spaceproperty") ) );
}
{ //::SireMove::Replicas::setSubSystem
typedef void ( ::SireMove::Replicas::*setSubSystem_function_type )( ::SireSystem::System const & ) ;
setSubSystem_function_type setSubSystem_function_value( &::SireMove::Replicas::setSubSystem );
Replicas_exposer.def(
"setSubSystem"
, setSubSystem_function_value
, ( bp::arg("system") ) );
}
{ //::SireMove::Replicas::setSubSystem
typedef void ( ::SireMove::Replicas::*setSubSystem_function_type )( ::SireMove::SupraSubSystem const & ) ;
setSubSystem_function_type setSubSystem_function_value( &::SireMove::Replicas::setSubSystem );
Replicas_exposer.def(
"setSubSystem"
, setSubSystem_function_value
, ( bp::arg("subsystem") ) );
}
{ //::SireMove::Replicas::setSubSystem
typedef void ( ::SireMove::Replicas::*setSubSystem_function_type )( int,::SireSystem::System const & ) ;
setSubSystem_function_type setSubSystem_function_value( &::SireMove::Replicas::setSubSystem );
Replicas_exposer.def(
"setSubSystem"
, setSubSystem_function_value
, ( bp::arg("i"), bp::arg("system") ) );
}
{ //::SireMove::Replicas::setSubSystem
typedef void ( ::SireMove::Replicas::*setSubSystem_function_type )( int,::SireMove::SupraSubSystem const & ) ;
setSubSystem_function_type setSubSystem_function_value( &::SireMove::Replicas::setSubSystem );
Replicas_exposer.def(
"setSubSystem"
, setSubSystem_function_value
, ( bp::arg("i"), bp::arg("subsystem") ) );
}
{ //::SireMove::Replicas::setTemperature
typedef void ( ::SireMove::Replicas::*setTemperature_function_type )( ::SireUnits::Dimension::Temperature const & ) ;
setTemperature_function_type setTemperature_function_value( &::SireMove::Replicas::setTemperature );
Replicas_exposer.def(
"setTemperature"
, setTemperature_function_value
, ( bp::arg("temperature") ) );
}
{ //::SireMove::Replicas::setTemperature
typedef void ( ::SireMove::Replicas::*setTemperature_function_type )( int,::SireUnits::Dimension::Temperature const & ) ;
setTemperature_function_type setTemperature_function_value( &::SireMove::Replicas::setTemperature );
Replicas_exposer.def(
"setTemperature"
, setTemperature_function_value
, ( bp::arg("i"), bp::arg("temperature") ) );
}
{ //::SireMove::Replicas::swapMolecules
typedef void ( ::SireMove::Replicas::*swapMolecules_function_type )( int,int ) ;
swapMolecules_function_type swapMolecules_function_value( &::SireMove::Replicas::swapMolecules );
Replicas_exposer.def(
"swapMolecules"
, swapMolecules_function_value
, ( bp::arg("i"), bp::arg("j") ) );
}
{ //::SireMove::Replicas::swapSystems
typedef void ( ::SireMove::Replicas::*swapSystems_function_type )( int,int,bool ) ;
swapSystems_function_type swapSystems_function_value( &::SireMove::Replicas::swapSystems );
Replicas_exposer.def(
"swapSystems"
, swapSystems_function_value
, ( bp::arg("i"), bp::arg("j"), bp::arg("swap_monitors")=(bool)(true) ) );
}
{ //::SireMove::Replicas::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMove::Replicas::typeName );
Replicas_exposer.def(
"typeName"
, typeName_function_value );
}
Replicas_exposer.staticmethod( "typeName" );
Replicas_exposer.def( "__copy__", &__copy__);
Replicas_exposer.def( "__deepcopy__", &__copy__);
Replicas_exposer.def( "clone", &__copy__);
Replicas_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMove::Replicas >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Replicas_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMove::Replicas >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Replicas_exposer.def( "__str__", &__str__< ::SireMove::Replicas > );
Replicas_exposer.def( "__repr__", &__str__< ::SireMove::Replicas > );
Replicas_exposer.def( "__len__", &__len_size< ::SireMove::Replicas > );
}
}
void register_CoordGroupArray_class(){
{ //::SireVol::CoordGroupArray
typedef bp::class_< SireVol::CoordGroupArray > CoordGroupArray_exposer_t;
CoordGroupArray_exposer_t CoordGroupArray_exposer = CoordGroupArray_exposer_t( "CoordGroupArray", "This class holds an array of CoordGroups. While you could\nof course just use a QVector<CoordGroup>, this array\noptimises the memory layout of all of the CoordGroups\nso that they all lie contiguously along the same piece\nof memory (and indeed, all of the AABoxes are grouped\ntogether, while all of the coordinates are grouped together).\n\nThe memory packing means that this array is much more\nlimited than a QVector<CoordGroup>, i.e. you cant\nadd or remove CoordGroups from the array, and you cant\ndo anything to the contained CoordGroups except for\nchange their coordinates.\n\nThis class is really meant to be used as a fast container\nthat allow rapid iteration over all of the contained\nCoordGroups coordinates\n\nAuthor: Christopher Woods\n", bp::init< >("Null constructor") );
bp::scope CoordGroupArray_scope( CoordGroupArray_exposer );
CoordGroupArray_exposer.def( bp::init< SireVol::CoordGroup const & >(( bp::arg("cgroup") ), "Construct an array that holds just the passed CoordGroup") );
CoordGroupArray_exposer.def( bp::init< QVector< QVector< SireMaths::Vector > > const & >(( bp::arg("points") ), "Construct from a double-vector") );
CoordGroupArray_exposer.def( bp::init< QVector< SireVol::CoordGroup > const & >(( bp::arg("cgroups") ), "Construct from an array of CoordGroups") );
CoordGroupArray_exposer.def( bp::init< SireVol::CoordGroupArray const &, SireVol::CoordGroupArray const & >(( bp::arg("array0"), bp::arg("array1") ), "Construct from a pair of CoordGroupArrays") );
CoordGroupArray_exposer.def( bp::init< SireVol::CoordGroupArray const & >(( bp::arg("other") ), "Copy constructor") );
{ //::SireVol::CoordGroupArray::aaBox
typedef ::SireVol::AABox ( ::SireVol::CoordGroupArray::*aaBox_function_type)( ) const;
aaBox_function_type aaBox_function_value( &::SireVol::CoordGroupArray::aaBox );
CoordGroupArray_exposer.def(
"aaBox"
, aaBox_function_value
, "Return an AABox that complete encompasses all of the CoordGroups\nin this array" );
}
{ //::SireVol::CoordGroupArray::append
typedef void ( ::SireVol::CoordGroupArray::*append_function_type)( ::SireVol::CoordGroup const & ) ;
append_function_type append_function_value( &::SireVol::CoordGroupArray::append );
CoordGroupArray_exposer.def(
"append"
, append_function_value
, ( bp::arg("cgroup") )
, "Append the passed CoordGroup onto the end of this array" );
}
{ //::SireVol::CoordGroupArray::append
typedef void ( ::SireVol::CoordGroupArray::*append_function_type)( ::SireVol::CoordGroupArray const & ) ;
append_function_type append_function_value( &::SireVol::CoordGroupArray::append );
CoordGroupArray_exposer.def(
"append"
, append_function_value
, ( bp::arg("cgroups") )
, "Append the passed CoordGroups onto the end of this array" );
}
{ //::SireVol::CoordGroupArray::assertValidCoordGroup
typedef void ( ::SireVol::CoordGroupArray::*assertValidCoordGroup_function_type)( ::quint32 ) const;
assertValidCoordGroup_function_type assertValidCoordGroup_function_value( &::SireVol::CoordGroupArray::assertValidCoordGroup );
CoordGroupArray_exposer.def(
"assertValidCoordGroup"
, assertValidCoordGroup_function_value
, ( bp::arg("i") )
, "Assert that the index i points to a valid CoordGroup\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::assertValidCoordinate
typedef void ( ::SireVol::CoordGroupArray::*assertValidCoordinate_function_type)( ::quint32 ) const;
assertValidCoordinate_function_type assertValidCoordinate_function_value( &::SireVol::CoordGroupArray::assertValidCoordinate );
CoordGroupArray_exposer.def(
"assertValidCoordinate"
, assertValidCoordinate_function_value
, ( bp::arg("i") )
, "Assert that the index i points a valid coordinate\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::assertValidIndex
typedef void ( ::SireVol::CoordGroupArray::*assertValidIndex_function_type)( ::quint32 ) const;
assertValidIndex_function_type assertValidIndex_function_value( &::SireVol::CoordGroupArray::assertValidIndex );
CoordGroupArray_exposer.def(
"assertValidIndex"
, assertValidIndex_function_value
, ( bp::arg("i") )
, "Assert that the index i points to a valid CoordGroup\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::at
typedef ::SireVol::CoordGroup const & ( ::SireVol::CoordGroupArray::*at_function_type)( ::quint32 ) const;
at_function_type at_function_value( &::SireVol::CoordGroupArray::at );
CoordGroupArray_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "Return a reference to the ith CoordGroup\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::changeFrame
typedef void ( ::SireVol::CoordGroupArray::*changeFrame_function_type)( ::SireMaths::AxisSet const &,::SireMaths::AxisSet const & ) ;
changeFrame_function_type changeFrame_function_value( &::SireVol::CoordGroupArray::changeFrame );
CoordGroupArray_exposer.def(
"changeFrame"
, changeFrame_function_value
, ( bp::arg("from_frame"), bp::arg("to_frame") )
, "Change all of the coordinates in this array from the\ncoordinate frame from_frame to the coordinate frame to_frame" );
}
{ //::SireVol::CoordGroupArray::changeFrame
typedef void ( ::SireVol::CoordGroupArray::*changeFrame_function_type)( ::quint32,::SireMaths::AxisSet const &,::SireMaths::AxisSet const & ) ;
changeFrame_function_type changeFrame_function_value( &::SireVol::CoordGroupArray::changeFrame );
CoordGroupArray_exposer.def(
"changeFrame"
, changeFrame_function_value
, ( bp::arg("i"), bp::arg("from_frame"), bp::arg("to_frame") )
, "Change all of the coordinates in the ith CoordGroup from\nthe coordinate frame from_frame to the coordinate frame\nto_frame\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::count
typedef int ( ::SireVol::CoordGroupArray::*count_function_type)( ) const;
count_function_type count_function_value( &::SireVol::CoordGroupArray::count );
CoordGroupArray_exposer.def(
"count"
, count_function_value
, "Return the number of CoordGroups in this array" );
}
{ //::SireVol::CoordGroupArray::isEmpty
typedef bool ( ::SireVol::CoordGroupArray::*isEmpty_function_type)( ) const;
isEmpty_function_type isEmpty_function_value( &::SireVol::CoordGroupArray::isEmpty );
CoordGroupArray_exposer.def(
"isEmpty"
, isEmpty_function_value
, "Return whether or not this array is empty" );
}
{ //::SireVol::CoordGroupArray::mapInto
typedef void ( ::SireVol::CoordGroupArray::*mapInto_function_type)( ::SireMaths::AxisSet const & ) ;
mapInto_function_type mapInto_function_value( &::SireVol::CoordGroupArray::mapInto );
CoordGroupArray_exposer.def(
"mapInto"
, mapInto_function_value
, ( bp::arg("axes") )
, "Map all of the coordinates in this array into the coordinate\nframe represented by axes" );
}
{ //::SireVol::CoordGroupArray::mapInto
typedef void ( ::SireVol::CoordGroupArray::*mapInto_function_type)( ::quint32,::SireMaths::AxisSet const & ) ;
mapInto_function_type mapInto_function_value( &::SireVol::CoordGroupArray::mapInto );
CoordGroupArray_exposer.def(
"mapInto"
, mapInto_function_value
, ( bp::arg("i"), bp::arg("axes") )
, "Map all of the coordinates of the CoordGroup at index i\ninto the coordinate frame represented by axes\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::merge
typedef ::SireVol::CoordGroup ( ::SireVol::CoordGroupArray::*merge_function_type)( ) const;
merge_function_type merge_function_value( &::SireVol::CoordGroupArray::merge );
CoordGroupArray_exposer.def(
"merge"
, merge_function_value
, "Merge this array of CoordGroups back into a single CoordGroup" );
}
{ //::SireVol::CoordGroupArray::nCoordGroups
typedef int ( ::SireVol::CoordGroupArray::*nCoordGroups_function_type)( ) const;
nCoordGroups_function_type nCoordGroups_function_value( &::SireVol::CoordGroupArray::nCoordGroups );
CoordGroupArray_exposer.def(
"nCoordGroups"
, nCoordGroups_function_value
, "Return the number of CoordGroups in this array" );
}
{ //::SireVol::CoordGroupArray::nCoords
typedef int ( ::SireVol::CoordGroupArray::*nCoords_function_type)( ) const;
nCoords_function_type nCoords_function_value( &::SireVol::CoordGroupArray::nCoords );
CoordGroupArray_exposer.def(
"nCoords"
, nCoords_function_value
, "Return the number of coordinates in this array" );
}
CoordGroupArray_exposer.def( bp::self != bp::self );
{ //::SireVol::CoordGroupArray::operator=
typedef ::SireVol::CoordGroupArray & ( ::SireVol::CoordGroupArray::*assign_function_type)( ::SireVol::CoordGroupArray const & ) ;
assign_function_type assign_function_value( &::SireVol::CoordGroupArray::operator= );
CoordGroupArray_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >()
, "" );
}
CoordGroupArray_exposer.def( bp::self == bp::self );
{ //::SireVol::CoordGroupArray::operator[]
typedef ::SireVol::CoordGroup const & ( ::SireVol::CoordGroupArray::*__getitem___function_type)( ::quint32 ) const;
__getitem___function_type __getitem___function_value( &::SireVol::CoordGroupArray::operator[] );
CoordGroupArray_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireVol::CoordGroupArray::remove
typedef void ( ::SireVol::CoordGroupArray::*remove_function_type)( ::quint32 ) ;
remove_function_type remove_function_value( &::SireVol::CoordGroupArray::remove );
CoordGroupArray_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("i") )
, "Remove the ith CoordGroup from the array" );
}
{ //::SireVol::CoordGroupArray::remove
typedef void ( ::SireVol::CoordGroupArray::*remove_function_type)( ::quint32,int ) ;
remove_function_type remove_function_value( &::SireVol::CoordGroupArray::remove );
CoordGroupArray_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("i"), bp::arg("count") )
, "Remove count CoordGroups from the array, starting with the ith CoordGroup" );
}
{ //::SireVol::CoordGroupArray::remove
typedef void ( ::SireVol::CoordGroupArray::*remove_function_type)( ::QVarLengthArray< unsigned int, 256 > const & ) ;
remove_function_type remove_function_value( &::SireVol::CoordGroupArray::remove );
CoordGroupArray_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("idxs") )
, "Remove the specified CoordGroups from the array" );
}
{ //::SireVol::CoordGroupArray::rotate
typedef void ( ::SireVol::CoordGroupArray::*rotate_function_type)( ::SireMaths::Quaternion const &,::SireMaths::Vector const & ) ;
rotate_function_type rotate_function_value( &::SireVol::CoordGroupArray::rotate );
CoordGroupArray_exposer.def(
"rotate"
, rotate_function_value
, ( bp::arg("quat"), bp::arg("point") )
, "Rotate all of the coordinates in this array using the quaternion\nquat around the point point" );
}
{ //::SireVol::CoordGroupArray::rotate
typedef void ( ::SireVol::CoordGroupArray::*rotate_function_type)( ::SireMaths::Matrix const &,::SireMaths::Vector const & ) ;
rotate_function_type rotate_function_value( &::SireVol::CoordGroupArray::rotate );
CoordGroupArray_exposer.def(
"rotate"
, rotate_function_value
, ( bp::arg("rotmat"), bp::arg("point") )
, "Rotate all of coordinates in this array using the matrix rotmat\nabout the point point" );
}
{ //::SireVol::CoordGroupArray::rotate
typedef void ( ::SireVol::CoordGroupArray::*rotate_function_type)( ::quint32,::SireMaths::Quaternion const &,::SireMaths::Vector const & ) ;
rotate_function_type rotate_function_value( &::SireVol::CoordGroupArray::rotate );
CoordGroupArray_exposer.def(
"rotate"
, rotate_function_value
, ( bp::arg("i"), bp::arg("quat"), bp::arg("point") )
, "Rotate all of the coordinates in the CoordGroup at index i using\nthe quaternion quat about the point point\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::rotate
typedef void ( ::SireVol::CoordGroupArray::*rotate_function_type)( ::quint32,::SireMaths::Matrix const &,::SireMaths::Vector const & ) ;
rotate_function_type rotate_function_value( &::SireVol::CoordGroupArray::rotate );
CoordGroupArray_exposer.def(
"rotate"
, rotate_function_value
, ( bp::arg("i"), bp::arg("rotmat"), bp::arg("point") )
, "Rotate all of the coordinates in the CoordGroup at index i using\nthe matrix rotmat about the point point\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::size
typedef int ( ::SireVol::CoordGroupArray::*size_function_type)( ) const;
size_function_type size_function_value( &::SireVol::CoordGroupArray::size );
CoordGroupArray_exposer.def(
"size"
, size_function_value
, "Return the number of CoordGroups in this array" );
}
{ //::SireVol::CoordGroupArray::toString
typedef ::QString ( ::SireVol::CoordGroupArray::*toString_function_type)( ) const;
toString_function_type toString_function_value( &::SireVol::CoordGroupArray::toString );
CoordGroupArray_exposer.def(
"toString"
, toString_function_value
, "Return a string representation of this array" );
}
{ //::SireVol::CoordGroupArray::transform
typedef void ( ::SireVol::CoordGroupArray::*transform_function_type)( ::SireMaths::Transform const & ) ;
transform_function_type transform_function_value( &::SireVol::CoordGroupArray::transform );
CoordGroupArray_exposer.def(
"transform"
, transform_function_value
, ( bp::arg("t") )
, "Transform all of coordinates in this array using the transformation t" );
}
{ //::SireVol::CoordGroupArray::transform
typedef void ( ::SireVol::CoordGroupArray::*transform_function_type)( ::quint32,::SireMaths::Transform const & ) ;
transform_function_type transform_function_value( &::SireVol::CoordGroupArray::transform );
CoordGroupArray_exposer.def(
"transform"
, transform_function_value
, ( bp::arg("i"), bp::arg("t") )
, "Transform all of the coordinates in the CoordGroup at index i using\nthe transformation t\nThrow: SireError::invalid_index\n" );
}
{ //::SireVol::CoordGroupArray::translate
typedef void ( ::SireVol::CoordGroupArray::*translate_function_type)( ::SireMaths::Vector const & ) ;
translate_function_type translate_function_value( &::SireVol::CoordGroupArray::translate );
CoordGroupArray_exposer.def(
"translate"
, translate_function_value
, ( bp::arg("delta") )
, "Translate all of the coordinates in this array by delta" );
}
{ //::SireVol::CoordGroupArray::translate
typedef void ( ::SireVol::CoordGroupArray::*translate_function_type)( ::quint32,::SireMaths::Vector const & ) ;
translate_function_type translate_function_value( &::SireVol::CoordGroupArray::translate );
CoordGroupArray_exposer.def(
"translate"
, translate_function_value
, ( bp::arg("i"), bp::arg("delta") )
, "Translate all of the coordinates in the ith CoordGroup by delta" );
}
{ //::SireVol::CoordGroupArray::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireVol::CoordGroupArray::typeName );
CoordGroupArray_exposer.def(
"typeName"
, typeName_function_value
, "" );
}
{ //::SireVol::CoordGroupArray::update
typedef void ( ::SireVol::CoordGroupArray::*update_function_type)( ::quint32,::SireVol::CoordGroup const & ) ;
update_function_type update_function_value( &::SireVol::CoordGroupArray::update );
CoordGroupArray_exposer.def(
"update"
, update_function_value
, ( bp::arg("i"), bp::arg("cgroup") )
, "Update the CoordGroup at index i so that it is equal to cgroup. Note\nthat cgroup must contain the same number of coordinates as the existing\nCoordGroup at this index\nThrow: SireError::invalid_index\nThrow: SireError::incompatible_error\n" );
}
{ //::SireVol::CoordGroupArray::update
typedef void ( ::SireVol::CoordGroupArray::*update_function_type)( ::quint32,::QVector< SireMaths::Vector > const & ) ;
update_function_type update_function_value( &::SireVol::CoordGroupArray::update );
CoordGroupArray_exposer.def(
"update"
, update_function_value
, ( bp::arg("i"), bp::arg("coords") )
, "Update the CoordGroup at index i so that it has coordinates coords\nThere must contain the same number of coordinates as the existing\nCoordGroup at this index\nThrow: SireError::invalid_index\nThrow: SireError::incompatible_error\n" );
}
{ //::SireVol::CoordGroupArray::update
typedef void ( ::SireVol::CoordGroupArray::*update_function_type)( ::quint32,::SireMaths::Vector const *,int ) ;
update_function_type update_function_value( &::SireVol::CoordGroupArray::update );
CoordGroupArray_exposer.def(
"update"
, update_function_value
, ( bp::arg("i"), bp::arg("coords"), bp::arg("ncoords") )
, "Update the CoordGroup at index i so that it has coordinates coords\n(there are ncoords coordinates in this array)\nThere must contain the same number of coordinates as the existing\nCoordGroup at this index\nThrow: SireError::invalid_index\nThrow: SireError::incompatible_error\n" );
}
{ //::SireVol::CoordGroupArray::what
typedef char const * ( ::SireVol::CoordGroupArray::*what_function_type)( ) const;
what_function_type what_function_value( &::SireVol::CoordGroupArray::what );
CoordGroupArray_exposer.def(
"what"
, what_function_value
, "" );
}
CoordGroupArray_exposer.staticmethod( "typeName" );
CoordGroupArray_exposer.def( "__copy__", &__copy__);
CoordGroupArray_exposer.def( "__deepcopy__", &__copy__);
CoordGroupArray_exposer.def( "clone", &__copy__);
CoordGroupArray_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireVol::CoordGroupArray >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
CoordGroupArray_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireVol::CoordGroupArray >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
CoordGroupArray_exposer.def( "__str__", &__str__< ::SireVol::CoordGroupArray > );
CoordGroupArray_exposer.def( "__repr__", &__str__< ::SireVol::CoordGroupArray > );
CoordGroupArray_exposer.def( "__len__", &__len_size< ::SireVol::CoordGroupArray > );
}
}
void register_PackedArray2D_QString__class(){
{ //::SireBase::PackedArray2D< QString >
typedef bp::class_< SireBase::PackedArray2D< QString > > PackedArray2D_QString__exposer_t;
PackedArray2D_QString__exposer_t PackedArray2D_QString__exposer = PackedArray2D_QString__exposer_t( "PackedArray2D_QString_", bp::init< >() );
bp::scope PackedArray2D_QString__scope( PackedArray2D_QString__exposer );
PackedArray2D_QString__exposer.def( bp::init< SireBase::detail::PackedArray2D_Array< QString > const & >(( bp::arg("array") )) );
PackedArray2D_QString__exposer.def( bp::init< QVector< SireBase::detail::PackedArray2D_Array< QString > > const & >(( bp::arg("arrays") )) );
PackedArray2D_QString__exposer.def( bp::init< QVector< QString > const & >(( bp::arg("values") )) );
PackedArray2D_QString__exposer.def( bp::init< QVector< QVector< QString > > const & >(( bp::arg("values") )) );
PackedArray2D_QString__exposer.def( bp::init< SireBase::PackedArray2D< QString > const &, SireBase::PackedArray2D< QString > const & >(( bp::arg("array0"), bp::arg("array1") )) );
PackedArray2D_QString__exposer.def( bp::init< SireBase::PackedArray2D< QString > const & >(( bp::arg("other") )) );
{ //::SireBase::PackedArray2D< QString >::append
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*append_function_type )( ::SireBase::detail::PackedArray2D_Array< QString > const & ) ;
append_function_type append_function_value( &::SireBase::PackedArray2D< QString >::append );
PackedArray2D_QString__exposer.def(
"append"
, append_function_value
, ( bp::arg("array") ) );
}
{ //::SireBase::PackedArray2D< QString >::append
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*append_function_type )( ::SireBase::PackedArray2D< QString > const & ) ;
append_function_type append_function_value( &::SireBase::PackedArray2D< QString >::append );
PackedArray2D_QString__exposer.def(
"append"
, append_function_value
, ( bp::arg("arrays") ) );
}
{ //::SireBase::PackedArray2D< QString >::append
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*append_function_type )( ::QVector< QString > const & ) ;
append_function_type append_function_value( &::SireBase::PackedArray2D< QString >::append );
PackedArray2D_QString__exposer.def(
"append"
, append_function_value
, ( bp::arg("array") ) );
}
{ //::SireBase::PackedArray2D< QString >::append
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*append_function_type )( ::QVector< QVector< QString > > const & ) ;
append_function_type append_function_value( &::SireBase::PackedArray2D< QString >::append );
PackedArray2D_QString__exposer.def(
"append"
, append_function_value
, ( bp::arg("arrays") ) );
}
{ //::SireBase::PackedArray2D< QString >::assertValidIndex
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*assertValidIndex_function_type )( ::quint32 ) const;
assertValidIndex_function_type assertValidIndex_function_value( &::SireBase::PackedArray2D< QString >::assertValidIndex );
PackedArray2D_QString__exposer.def(
"assertValidIndex"
, assertValidIndex_function_value
, ( bp::arg("i") ) );
}
{ //::SireBase::PackedArray2D< QString >::at
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::SireBase::detail::PackedArray2D_Array< QString > const & ( ::SireBase::PackedArray2D< QString >::*at_function_type )( ::quint32 ) const;
at_function_type at_function_value( &::SireBase::PackedArray2D< QString >::at );
PackedArray2D_QString__exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::PackedArray2D< QString >::at
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::QString const & ( ::SireBase::PackedArray2D< QString >::*at_function_type )( ::quint32,::quint32 ) const;
at_function_type at_function_value( &::SireBase::PackedArray2D< QString >::at );
PackedArray2D_QString__exposer.def(
"at"
, at_function_value
, ( bp::arg("i"), bp::arg("j") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::PackedArray2D< QString >::count
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef int ( ::SireBase::PackedArray2D< QString >::*count_function_type )( ) const;
count_function_type count_function_value( &::SireBase::PackedArray2D< QString >::count );
PackedArray2D_QString__exposer.def(
"count"
, count_function_value );
}
{ //::SireBase::PackedArray2D< QString >::fromVariant
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::SireBase::PackedArray2D< QString > ( *fromVariant_function_type )( ::SireBase::PackedArray2D< QVariant > const & );
fromVariant_function_type fromVariant_function_value( &::SireBase::PackedArray2D< QString >::fromVariant );
PackedArray2D_QString__exposer.def(
"fromVariant"
, fromVariant_function_value
, ( bp::arg("variant") ) );
}
{ //::SireBase::PackedArray2D< QString >::isEmpty
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef bool ( ::SireBase::PackedArray2D< QString >::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireBase::PackedArray2D< QString >::isEmpty );
PackedArray2D_QString__exposer.def(
"isEmpty"
, isEmpty_function_value );
}
{ //::SireBase::PackedArray2D< QString >::nArrays
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef int ( ::SireBase::PackedArray2D< QString >::*nArrays_function_type )( ) const;
nArrays_function_type nArrays_function_value( &::SireBase::PackedArray2D< QString >::nArrays );
PackedArray2D_QString__exposer.def(
"nArrays"
, nArrays_function_value );
}
{ //::SireBase::PackedArray2D< QString >::nValues
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef int ( ::SireBase::PackedArray2D< QString >::*nValues_function_type )( ) const;
nValues_function_type nValues_function_value( &::SireBase::PackedArray2D< QString >::nValues );
PackedArray2D_QString__exposer.def(
"nValues"
, nValues_function_value );
}
{ //::SireBase::PackedArray2D< QString >::nValues
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef int ( ::SireBase::PackedArray2D< QString >::*nValues_function_type )( ::quint32 ) const;
nValues_function_type nValues_function_value( &::SireBase::PackedArray2D< QString >::nValues );
PackedArray2D_QString__exposer.def(
"nValues"
, nValues_function_value
, ( bp::arg("i") ) );
}
PackedArray2D_QString__exposer.def( bp::self != bp::self );
{ //::SireBase::PackedArray2D< QString >::operator()
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::QString const & ( ::SireBase::PackedArray2D< QString >::*__call___function_type )( ::quint32,::quint32 ) const;
__call___function_type __call___function_value( &::SireBase::PackedArray2D< QString >::operator() );
PackedArray2D_QString__exposer.def(
"__call__"
, __call___function_value
, ( bp::arg("i"), bp::arg("j") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::PackedArray2D< QString >::operator=
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::SireBase::PackedArray2D< QString > & ( ::SireBase::PackedArray2D< QString >::*assign_function_type )( ::SireBase::PackedArray2D< QString > const & ) ;
assign_function_type assign_function_value( &::SireBase::PackedArray2D< QString >::operator= );
PackedArray2D_QString__exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
PackedArray2D_QString__exposer.def( bp::self == bp::self );
{ //::SireBase::PackedArray2D< QString >::operator[]
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::SireBase::detail::PackedArray2D_Array< QString > const & ( ::SireBase::PackedArray2D< QString >::*__getitem___function_type )( ::quint32 ) const;
__getitem___function_type __getitem___function_value( &::SireBase::PackedArray2D< QString >::operator[] );
PackedArray2D_QString__exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::PackedArray2D< QString >::remove
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*remove_function_type )( ::quint32 ) ;
remove_function_type remove_function_value( &::SireBase::PackedArray2D< QString >::remove );
PackedArray2D_QString__exposer.def(
"remove"
, remove_function_value
, ( bp::arg("i") ) );
}
{ //::SireBase::PackedArray2D< QString >::removeAll
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*removeAll_function_type )( ::QVarLengthArray< int, 256 > const & ) ;
removeAll_function_type removeAll_function_value( &::SireBase::PackedArray2D< QString >::removeAll );
PackedArray2D_QString__exposer.def(
"removeAll"
, removeAll_function_value
, ( bp::arg("idxs") ) );
}
{ //::SireBase::PackedArray2D< QString >::size
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef int ( ::SireBase::PackedArray2D< QString >::*size_function_type )( ) const;
size_function_type size_function_value( &::SireBase::PackedArray2D< QString >::size );
PackedArray2D_QString__exposer.def(
"size"
, size_function_value );
}
{ //::SireBase::PackedArray2D< QString >::toQVector
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::QVector< QString > ( ::SireBase::PackedArray2D< QString >::*toQVector_function_type )( ) const;
toQVector_function_type toQVector_function_value( &::SireBase::PackedArray2D< QString >::toQVector );
PackedArray2D_QString__exposer.def(
"toQVector"
, toQVector_function_value );
}
{ //::SireBase::PackedArray2D< QString >::toQVectorVector
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::QVector< QVector< QString > > ( ::SireBase::PackedArray2D< QString >::*toQVectorVector_function_type )( ) const;
toQVectorVector_function_type toQVectorVector_function_value( &::SireBase::PackedArray2D< QString >::toQVectorVector );
PackedArray2D_QString__exposer.def(
"toQVectorVector"
, toQVectorVector_function_value );
}
{ //::SireBase::PackedArray2D< QString >::toString
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::QString ( ::SireBase::PackedArray2D< QString >::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireBase::PackedArray2D< QString >::toString );
PackedArray2D_QString__exposer.def(
"toString"
, toString_function_value );
}
{ //::SireBase::PackedArray2D< QString >::toVariant
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef ::SireBase::PackedArray2D< QVariant > ( ::SireBase::PackedArray2D< QString >::*toVariant_function_type )( ) const;
toVariant_function_type toVariant_function_value( &::SireBase::PackedArray2D< QString >::toVariant );
PackedArray2D_QString__exposer.def(
"toVariant"
, toVariant_function_value );
}
{ //::SireBase::PackedArray2D< QString >::update
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*update_function_type )( ::quint32,::SireBase::detail::PackedArray2D_Array< QString > const & ) ;
update_function_type update_function_value( &::SireBase::PackedArray2D< QString >::update );
PackedArray2D_QString__exposer.def(
"update"
, update_function_value
, ( bp::arg("i"), bp::arg("array") ) );
}
{ //::SireBase::PackedArray2D< QString >::update
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*update_function_type )( ::quint32,::QVector< QString > const & ) ;
update_function_type update_function_value( &::SireBase::PackedArray2D< QString >::update );
PackedArray2D_QString__exposer.def(
"update"
, update_function_value
, ( bp::arg("i"), bp::arg("array") ) );
}
{ //::SireBase::PackedArray2D< QString >::updateAll
typedef SireBase::PackedArray2D< QString > exported_class_t;
typedef void ( ::SireBase::PackedArray2D< QString >::*updateAll_function_type )( ::QVarLengthArray< int, 256 > const &,::SireBase::PackedArray2D< QString > const & ) ;
updateAll_function_type updateAll_function_value( &::SireBase::PackedArray2D< QString >::updateAll );
PackedArray2D_QString__exposer.def(
"updateAll"
, updateAll_function_value
, ( bp::arg("idxs"), bp::arg("arrays") ) );
}
PackedArray2D_QString__exposer.staticmethod( "fromVariant" );
PackedArray2D_QString__exposer.def( "__copy__", &__copy__);
PackedArray2D_QString__exposer.def( "__deepcopy__", &__copy__);
PackedArray2D_QString__exposer.def( "clone", &__copy__);
PackedArray2D_QString__exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireBase::PackedArray2D<QString> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
PackedArray2D_QString__exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireBase::PackedArray2D<QString> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
PackedArray2D_QString__exposer.def( "__str__", &__str__< ::SireBase::PackedArray2D<QString> > );
PackedArray2D_QString__exposer.def( "__repr__", &__str__< ::SireBase::PackedArray2D<QString> > );
PackedArray2D_QString__exposer.def( "__len__", &__len_size< ::SireBase::PackedArray2D<QString> > );
}
}
void register_GridPotentialTable_class(){
{ //::SireFF::GridPotentialTable
typedef bp::class_< SireFF::GridPotentialTable > GridPotentialTable_exposer_t;
GridPotentialTable_exposer_t GridPotentialTable_exposer = GridPotentialTable_exposer_t( "GridPotentialTable", "A GridPotentialTable contains the potentials at point specified by a grid", bp::init< >("Null constructor") );
bp::scope GridPotentialTable_scope( GridPotentialTable_exposer );
GridPotentialTable_exposer.def( bp::init< SireVol::Grid const & >(( bp::arg("grid") ), "Construct to hold the potential at each of the points of the passed grid") );
GridPotentialTable_exposer.def( bp::init< SireFF::GridPotentialTable const & >(( bp::arg("other") ), "Copy constructor") );
{ //::SireFF::GridPotentialTable::add
typedef void ( ::SireFF::GridPotentialTable::*add_function_type)( int,::SireUnits::Dimension::MolarEnergy const & ) ;
add_function_type add_function_value( &::SireFF::GridPotentialTable::add );
GridPotentialTable_exposer.def(
"add"
, add_function_value
, ( bp::arg("ipoint"), bp::arg("potential") )
, "Add the potential potential onto the potential for the ipointth grid point\nThrow: SireError::invalid_index\n" );
}
{ //::SireFF::GridPotentialTable::add
typedef void ( ::SireFF::GridPotentialTable::*add_function_type)( ::SireFF::GridPotentialTable const & ) ;
add_function_type add_function_value( &::SireFF::GridPotentialTable::add );
GridPotentialTable_exposer.def(
"add"
, add_function_value
, ( bp::arg("other") )
, "Add the potential in other onto that for this table - this only\nadds the potential if the two grids are identical" );
}
{ //::SireFF::GridPotentialTable::add
typedef void ( ::SireFF::GridPotentialTable::*add_function_type)( ::SireUnits::Dimension::MolarEnergy const & ) ;
add_function_type add_function_value( &::SireFF::GridPotentialTable::add );
GridPotentialTable_exposer.def(
"add"
, add_function_value
, ( bp::arg("potential") )
, "Add the potential potential to all of the points in this table" );
}
{ //::SireFF::GridPotentialTable::at
typedef ::SireUnits::Dimension::MolarEnergy const & ( ::SireFF::GridPotentialTable::*at_function_type)( int ) const;
at_function_type at_function_value( &::SireFF::GridPotentialTable::at );
GridPotentialTable_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "Return the potential value of the ith grid point\nThrow: SireError::invalid_index\n" );
}
{ //::SireFF::GridPotentialTable::count
typedef int ( ::SireFF::GridPotentialTable::*count_function_type)( ) const;
count_function_type count_function_value( &::SireFF::GridPotentialTable::count );
GridPotentialTable_exposer.def(
"count"
, count_function_value
, "Return the number of grid points (and thus potential values)" );
}
{ //::SireFF::GridPotentialTable::divide
typedef void ( ::SireFF::GridPotentialTable::*divide_function_type)( double ) ;
divide_function_type divide_function_value( &::SireFF::GridPotentialTable::divide );
GridPotentialTable_exposer.def(
"divide"
, divide_function_value
, ( bp::arg("value") )
, "Divide the potential at all of the points in this table by value" );
}
{ //::SireFF::GridPotentialTable::grid
typedef ::SireVol::Grid const & ( ::SireFF::GridPotentialTable::*grid_function_type)( ) const;
grid_function_type grid_function_value( &::SireFF::GridPotentialTable::grid );
GridPotentialTable_exposer.def(
"grid"
, grid_function_value
, bp::return_value_policy<bp::clone_const_reference>()
, "Return the grid that contains the points at which the potential is\nevaluated - the order of points in the grid is the same as the order\nof potential values in this table" );
}
{ //::SireFF::GridPotentialTable::initialise
typedef void ( ::SireFF::GridPotentialTable::*initialise_function_type)( ) ;
initialise_function_type initialise_function_value( &::SireFF::GridPotentialTable::initialise );
GridPotentialTable_exposer.def(
"initialise"
, initialise_function_value
, "Initialise the potential at each grid point to equal 0" );
}
{ //::SireFF::GridPotentialTable::multiply
typedef void ( ::SireFF::GridPotentialTable::*multiply_function_type)( double ) ;
multiply_function_type multiply_function_value( &::SireFF::GridPotentialTable::multiply );
GridPotentialTable_exposer.def(
"multiply"
, multiply_function_value
, ( bp::arg("value") )
, "Multiply the potential at all of the points in this table by value" );
}
{ //::SireFF::GridPotentialTable::nPoints
typedef int ( ::SireFF::GridPotentialTable::*nPoints_function_type)( ) const;
nPoints_function_type nPoints_function_value( &::SireFF::GridPotentialTable::nPoints );
GridPotentialTable_exposer.def(
"nPoints"
, nPoints_function_value
, "Return the number of grid points (and thus potential values)" );
}
GridPotentialTable_exposer.def( bp::self != bp::self );
GridPotentialTable_exposer.def( bp::self * bp::other< double >() );
GridPotentialTable_exposer.def( bp::self + bp::self );
GridPotentialTable_exposer.def( bp::self + bp::other< SireUnits::Dimension::PhysUnit< 1, 2, -2, 0, 0, -1, 0 > >() );
GridPotentialTable_exposer.def( bp::self - bp::self );
GridPotentialTable_exposer.def( bp::self - bp::other< SireUnits::Dimension::PhysUnit< 1, 2, -2, 0, 0, -1, 0 > >() );
GridPotentialTable_exposer.def( -bp::self );
GridPotentialTable_exposer.def( bp::self / bp::other< double >() );
{ //::SireFF::GridPotentialTable::operator=
typedef ::SireFF::GridPotentialTable & ( ::SireFF::GridPotentialTable::*assign_function_type)( ::SireFF::GridPotentialTable const & ) ;
assign_function_type assign_function_value( &::SireFF::GridPotentialTable::operator= );
GridPotentialTable_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >()
, "" );
}
{ //::SireFF::GridPotentialTable::operator=
typedef ::SireFF::GridPotentialTable & ( ::SireFF::GridPotentialTable::*assign_function_type)( ::SireUnits::Dimension::MolarEnergy const & ) ;
assign_function_type assign_function_value( &::SireFF::GridPotentialTable::operator= );
GridPotentialTable_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("potential") )
, bp::return_self< >()
, "" );
}
GridPotentialTable_exposer.def( bp::self == bp::self );
{ //::SireFF::GridPotentialTable::operator[]
typedef ::SireUnits::Dimension::MolarEnergy & ( ::SireFF::GridPotentialTable::*__getitem___function_type)( int ) ;
__getitem___function_type __getitem___function_value( &::SireFF::GridPotentialTable::operator[] );
GridPotentialTable_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_internal_reference< >()
, "" );
}
{ //::SireFF::GridPotentialTable::operator[]
typedef ::SireUnits::Dimension::MolarEnergy const & ( ::SireFF::GridPotentialTable::*__getitem___function_type)( int ) const;
__getitem___function_type __getitem___function_value( &::SireFF::GridPotentialTable::operator[] );
GridPotentialTable_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireFF::GridPotentialTable::setAll
typedef void ( ::SireFF::GridPotentialTable::*setAll_function_type)( ::SireUnits::Dimension::MolarEnergy const & ) ;
setAll_function_type setAll_function_value( &::SireFF::GridPotentialTable::setAll );
GridPotentialTable_exposer.def(
"setAll"
, setAll_function_value
, ( bp::arg("potential") )
, "Set the potential at all of the points in this table equal to potential" );
}
{ //::SireFF::GridPotentialTable::subtract
typedef void ( ::SireFF::GridPotentialTable::*subtract_function_type)( int,::SireUnits::Dimension::MolarEnergy const & ) ;
subtract_function_type subtract_function_value( &::SireFF::GridPotentialTable::subtract );
GridPotentialTable_exposer.def(
"subtract"
, subtract_function_value
, ( bp::arg("ipoint"), bp::arg("potential") )
, "Subtract the potential potential from the potential for the ipointth grid point\nThrow: SireError::invalid_index\n" );
}
{ //::SireFF::GridPotentialTable::subtract
typedef void ( ::SireFF::GridPotentialTable::*subtract_function_type)( ::SireFF::GridPotentialTable const & ) ;
subtract_function_type subtract_function_value( &::SireFF::GridPotentialTable::subtract );
GridPotentialTable_exposer.def(
"subtract"
, subtract_function_value
, ( bp::arg("other") )
, "Subtract the potential in other from that for this table - this only\nsubtracts the potential if the two grids are identical" );
}
{ //::SireFF::GridPotentialTable::subtract
typedef void ( ::SireFF::GridPotentialTable::*subtract_function_type)( ::SireUnits::Dimension::MolarEnergy const & ) ;
subtract_function_type subtract_function_value( &::SireFF::GridPotentialTable::subtract );
GridPotentialTable_exposer.def(
"subtract"
, subtract_function_value
, ( bp::arg("potential") )
, "Subtract the potential potential from all of the points in this table" );
}
{ //::SireFF::GridPotentialTable::toVector
typedef ::QVector< SireUnits::Dimension::PhysUnit< 1, 2, -2, 0, 0, -1, 0 > > ( ::SireFF::GridPotentialTable::*toVector_function_type)( ) const;
toVector_function_type toVector_function_value( &::SireFF::GridPotentialTable::toVector );
GridPotentialTable_exposer.def(
"toVector"
, toVector_function_value
, "Return the array of potential values - the order is the same\nas the order of points in the grid" );
}
{ //::SireFF::GridPotentialTable::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireFF::GridPotentialTable::typeName );
GridPotentialTable_exposer.def(
"typeName"
, typeName_function_value
, "" );
}
GridPotentialTable_exposer.staticmethod( "typeName" );
GridPotentialTable_exposer.def( "__copy__", &__copy__);
GridPotentialTable_exposer.def( "__deepcopy__", &__copy__);
GridPotentialTable_exposer.def( "clone", &__copy__);
GridPotentialTable_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireFF::GridPotentialTable >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
GridPotentialTable_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireFF::GridPotentialTable >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
GridPotentialTable_exposer.def( "__str__", &pvt_get_name);
GridPotentialTable_exposer.def( "__repr__", &pvt_get_name);
GridPotentialTable_exposer.def( "__len__", &__len_count< ::SireFF::GridPotentialTable > );
}
}
void register_MultiVector_class(){
{ //::SireMaths::MultiVector
typedef bp::class_< SireMaths::MultiVector > MultiVector_exposer_t;
MultiVector_exposer_t MultiVector_exposer = MultiVector_exposer_t( "MultiVector", "\nThis is a vectorised version of Vector, e.g. x, y, and z\nare held as MultiDouble objects, meaning that this is a\npacked vector of vectors\n\nAuthor: Christopher Woods\n", bp::init< >("") );
bp::scope MultiVector_scope( MultiVector_exposer );
MultiVector_exposer.def( bp::init< SireMaths::MultiDouble const & >(( bp::arg("value") ), "Copy constructor") );
MultiVector_exposer.def( bp::init< SireMaths::MultiDouble const &, SireMaths::MultiDouble const &, SireMaths::MultiDouble const & >(( bp::arg("x"), bp::arg("y"), bp::arg("z") ), "") );
MultiVector_exposer.def( bp::init< SireMaths::Vector const *, int >(( bp::arg("array"), bp::arg("size") ), "Construct from an array of Vectors. This array cannot be greater\nthan MultiDouble::size()") );
MultiVector_exposer.def( bp::init< QVector< SireMaths::Vector > const & >(( bp::arg("array") ), "Construct from an array of Vectors. This array cannot be greater\nthan MultiDouble::size()") );
MultiVector_exposer.def( bp::init< SireMaths::MultiVector const & >(( bp::arg("other") ), "Copy constructor") );
{ //::SireMaths::MultiVector::angle
typedef ::SireMaths::MultiDouble ( *angle_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
angle_function_type angle_function_value( &::SireMaths::MultiVector::angle );
MultiVector_exposer.def(
"angle"
, angle_function_value
, ( bp::arg("v0"), bp::arg("v1") )
, "Return the angle between vectors v0 and v1 - this is the smallest\nangle, and will always lie between 0 and 180 degrees" );
}
{ //::SireMaths::MultiVector::angle
typedef ::SireMaths::MultiDouble ( *angle_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
angle_function_type angle_function_value( &::SireMaths::MultiVector::angle );
MultiVector_exposer.def(
"angle"
, angle_function_value
, ( bp::arg("v0"), bp::arg("v1"), bp::arg("v2") )
, "Return the angle between v0-v1-v2 (treating the vectors as points in space)" );
}
{ //::SireMaths::MultiVector::at
typedef ::SireMaths::Vector ( ::SireMaths::MultiVector::*at_function_type)( int ) const;
at_function_type at_function_value( &::SireMaths::MultiVector::at );
MultiVector_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, "Access the ith vector in the MultiVector" );
}
{ //::SireMaths::MultiVector::b
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*b_function_type)( ) const;
b_function_type b_function_value( &::SireMaths::MultiVector::b );
MultiVector_exposer.def(
"b"
, b_function_value
, "Return the components via rgb (limited between 0 and 1)" );
}
{ //::SireMaths::MultiVector::bearing
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*bearing_function_type)( ) const;
bearing_function_type bearing_function_value( &::SireMaths::MultiVector::bearing );
MultiVector_exposer.def(
"bearing"
, bearing_function_value
, "Return the bearing of this vector against (0,1,0) (north) on the xy plane" );
}
{ //::SireMaths::MultiVector::bearingXY
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*bearingXY_function_type)( ::SireMaths::MultiVector const & ) const;
bearingXY_function_type bearingXY_function_value( &::SireMaths::MultiVector::bearingXY );
MultiVector_exposer.def(
"bearingXY"
, bearingXY_function_value
, ( bp::arg("v") )
, "Return the bearing of this vector against v on the xy plane" );
}
{ //::SireMaths::MultiVector::bearingXZ
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*bearingXZ_function_type)( ::SireMaths::MultiVector const & ) const;
bearingXZ_function_type bearingXZ_function_value( &::SireMaths::MultiVector::bearingXZ );
MultiVector_exposer.def(
"bearingXZ"
, bearingXZ_function_value
, ( bp::arg("v") )
, "Return the bearing of this vector against v on the xz plane" );
}
{ //::SireMaths::MultiVector::bearingYZ
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*bearingYZ_function_type)( ::SireMaths::MultiVector const & ) const;
bearingYZ_function_type bearingYZ_function_value( &::SireMaths::MultiVector::bearingYZ );
MultiVector_exposer.def(
"bearingYZ"
, bearingYZ_function_value
, ( bp::arg("v") )
, "Return the bearing of this vector against v on the yz plane" );
}
{ //::SireMaths::MultiVector::count
typedef int ( *count_function_type )( );
count_function_type count_function_value( &::SireMaths::MultiVector::count );
MultiVector_exposer.def(
"count"
, count_function_value
, "Return the number of vectors in this MultiVector" );
}
{ //::SireMaths::MultiVector::cross
typedef ::SireMaths::MultiVector ( *cross_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
cross_function_type cross_function_value( &::SireMaths::MultiVector::cross );
MultiVector_exposer.def(
"cross"
, cross_function_value
, ( bp::arg("v0"), bp::arg("v1") )
, "Return the cross product of v0 and v1" );
}
{ //::SireMaths::MultiVector::dihedral
typedef ::SireMaths::MultiDouble ( *dihedral_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const &,::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
dihedral_function_type dihedral_function_value( &::SireMaths::MultiVector::dihedral );
MultiVector_exposer.def(
"dihedral"
, dihedral_function_value
, ( bp::arg("v0"), bp::arg("v1"), bp::arg("v2"), bp::arg("v3") )
, "Return the dihedral angle between v0-v1-v2-v3 (treating the vectors as points)" );
}
{ //::SireMaths::MultiVector::direction
typedef ::SireMaths::MultiVector ( ::SireMaths::MultiVector::*direction_function_type)( ) const;
direction_function_type direction_function_value( &::SireMaths::MultiVector::direction );
MultiVector_exposer.def(
"direction"
, direction_function_value
, "Return the unit vector pointing in the direction of this vector" );
}
{ //::SireMaths::MultiVector::distance
typedef ::SireMaths::MultiDouble ( *distance_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
distance_function_type distance_function_value( &::SireMaths::MultiVector::distance );
MultiVector_exposer.def(
"distance"
, distance_function_value
, ( bp::arg("v1"), bp::arg("v2") )
, "Return the distance between two vectors" );
}
{ //::SireMaths::MultiVector::distance2
typedef ::SireMaths::MultiDouble ( *distance2_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
distance2_function_type distance2_function_value( &::SireMaths::MultiVector::distance2 );
MultiVector_exposer.def(
"distance2"
, distance2_function_value
, ( bp::arg("v1"), bp::arg("v2") )
, "Return the distance squared between two vectors" );
}
{ //::SireMaths::MultiVector::dot
typedef ::SireMaths::MultiDouble ( *dot_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
dot_function_type dot_function_value( &::SireMaths::MultiVector::dot );
MultiVector_exposer.def(
"dot"
, dot_function_value
, ( bp::arg("v0"), bp::arg("v1") )
, "Return the dot product of v0 and v1" );
}
{ //::SireMaths::MultiVector::fromArray
typedef ::QVector< SireMaths::MultiVector > ( *fromArray_function_type )( ::SireMaths::Vector const *,int );
fromArray_function_type fromArray_function_value( &::SireMaths::MultiVector::fromArray );
MultiVector_exposer.def(
"fromArray"
, fromArray_function_value
, ( bp::arg("array"), bp::arg("size") )
, "Convert the passed array of vectors into an array of MultiVectors" );
}
{ //::SireMaths::MultiVector::fromArray
typedef ::QVector< SireMaths::MultiVector > ( *fromArray_function_type )( ::QVector< SireMaths::Vector > const & );
fromArray_function_type fromArray_function_value( &::SireMaths::MultiVector::fromArray );
MultiVector_exposer.def(
"fromArray"
, fromArray_function_value
, ( bp::arg("array") )
, "Convert the passed array of vectors into an array of MultiVectors" );
}
{ //::SireMaths::MultiVector::g
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*g_function_type)( ) const;
g_function_type g_function_value( &::SireMaths::MultiVector::g );
MultiVector_exposer.def(
"g"
, g_function_value
, "Return the components via rgb (limited between 0 and 1)" );
}
{ //::SireMaths::MultiVector::generate
typedef ::SireMaths::MultiVector ( *generate_function_type )( ::SireMaths::MultiDouble const &,::SireMaths::MultiVector const &,::SireMaths::MultiDouble const &,::SireMaths::MultiVector const &,::SireMaths::MultiDouble const &,::SireMaths::MultiVector const & );
generate_function_type generate_function_value( &::SireMaths::MultiVector::generate );
MultiVector_exposer.def(
"generate"
, generate_function_value
, ( bp::arg("dst"), bp::arg("v1"), bp::arg("ang"), bp::arg("v2"), bp::arg("dih"), bp::arg("v3") )
, "Generate a vector, v0, that has distance dst v0-v1, angle ang v0-v1-v2,\nand dihedral dih v0-v1-v2-v3" );
}
{ //::SireMaths::MultiVector::getitem
typedef ::SireMaths::Vector ( ::SireMaths::MultiVector::*getitem_function_type)( int ) const;
getitem_function_type getitem_function_value( &::SireMaths::MultiVector::getitem );
MultiVector_exposer.def(
"getitem"
, getitem_function_value
, ( bp::arg("i") )
, "Access the ith vector in the MultiVector" );
}
{ //::SireMaths::MultiVector::invDistance
typedef ::SireMaths::MultiDouble ( *invDistance_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
invDistance_function_type invDistance_function_value( &::SireMaths::MultiVector::invDistance );
MultiVector_exposer.def(
"invDistance"
, invDistance_function_value
, ( bp::arg("v1"), bp::arg("v2") )
, "Return the 1 distance between two vectors" );
}
{ //::SireMaths::MultiVector::invDistance2
typedef ::SireMaths::MultiDouble ( *invDistance2_function_type )( ::SireMaths::MultiVector const &,::SireMaths::MultiVector const & );
invDistance2_function_type invDistance2_function_value( &::SireMaths::MultiVector::invDistance2 );
MultiVector_exposer.def(
"invDistance2"
, invDistance2_function_value
, ( bp::arg("v1"), bp::arg("v2") )
, "Return 1 distance2 between two vectors" );
}
{ //::SireMaths::MultiVector::invLength
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*invLength_function_type)( ) const;
invLength_function_type invLength_function_value( &::SireMaths::MultiVector::invLength );
MultiVector_exposer.def(
"invLength"
, invLength_function_value
, "" );
}
{ //::SireMaths::MultiVector::invLength2
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*invLength2_function_type)( ) const;
invLength2_function_type invLength2_function_value( &::SireMaths::MultiVector::invLength2 );
MultiVector_exposer.def(
"invLength2"
, invLength2_function_value
, "Return the inverse length squared" );
}
{ //::SireMaths::MultiVector::length
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*length_function_type)( ) const;
length_function_type length_function_value( &::SireMaths::MultiVector::length );
MultiVector_exposer.def(
"length"
, length_function_value
, "" );
}
{ //::SireMaths::MultiVector::length2
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*length2_function_type)( ) const;
length2_function_type length2_function_value( &::SireMaths::MultiVector::length2 );
MultiVector_exposer.def(
"length2"
, length2_function_value
, "" );
}
{ //::SireMaths::MultiVector::magnitude
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*magnitude_function_type)( ) const;
magnitude_function_type magnitude_function_value( &::SireMaths::MultiVector::magnitude );
MultiVector_exposer.def(
"magnitude"
, magnitude_function_value
, "Return the length of this vector" );
}
{ //::SireMaths::MultiVector::manhattanLength
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*manhattanLength_function_type)( ) const;
manhattanLength_function_type manhattanLength_function_value( &::SireMaths::MultiVector::manhattanLength );
MultiVector_exposer.def(
"manhattanLength"
, manhattanLength_function_value
, "Return the manhattan length of the vector" );
}
{ //::SireMaths::MultiVector::max
typedef ::SireMaths::MultiVector ( ::SireMaths::MultiVector::*max_function_type)( ::SireMaths::MultiVector const & ) const;
max_function_type max_function_value( &::SireMaths::MultiVector::max );
MultiVector_exposer.def(
"max"
, max_function_value
, ( bp::arg("other") )
, "Return a vector that has the maximum xyz components out of this\nand other" );
}
{ //::SireMaths::MultiVector::min
typedef ::SireMaths::MultiVector ( ::SireMaths::MultiVector::*min_function_type)( ::SireMaths::MultiVector const & ) const;
min_function_type min_function_value( &::SireMaths::MultiVector::min );
MultiVector_exposer.def(
"min"
, min_function_value
, ( bp::arg("other") )
, "Return a vector that has the minimum components" );
}
{ //::SireMaths::MultiVector::normalise
typedef ::SireMaths::MultiVector ( ::SireMaths::MultiVector::*normalise_function_type)( ) const;
normalise_function_type normalise_function_value( &::SireMaths::MultiVector::normalise );
MultiVector_exposer.def(
"normalise"
, normalise_function_value
, "Return a normalised form of the vector" );
}
MultiVector_exposer.def( bp::self != bp::self );
MultiVector_exposer.def( -bp::self );
{ //::SireMaths::MultiVector::operator=
typedef ::SireMaths::MultiVector & ( ::SireMaths::MultiVector::*assign_function_type)( ::SireMaths::MultiVector const & ) ;
assign_function_type assign_function_value( &::SireMaths::MultiVector::operator= );
MultiVector_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >()
, "" );
}
MultiVector_exposer.def( bp::self == bp::self );
{ //::SireMaths::MultiVector::operator[]
typedef ::SireMaths::Vector ( ::SireMaths::MultiVector::*__getitem___function_type)( int ) const;
__getitem___function_type __getitem___function_value( &::SireMaths::MultiVector::operator[] );
MultiVector_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, "" );
}
{ //::SireMaths::MultiVector::quickSet
typedef void ( ::SireMaths::MultiVector::*quickSet_function_type)( int,::SireMaths::Vector const & ) ;
quickSet_function_type quickSet_function_value( &::SireMaths::MultiVector::quickSet );
MultiVector_exposer.def(
"quickSet"
, quickSet_function_value
, ( bp::arg("i"), bp::arg("val") )
, "Quickly set the values of the vector, without checking the index is valid" );
}
{ //::SireMaths::MultiVector::r
typedef ::SireMaths::MultiDouble ( ::SireMaths::MultiVector::*r_function_type)( ) const;
r_function_type r_function_value( &::SireMaths::MultiVector::r );
MultiVector_exposer.def(
"r"
, r_function_value
, "Return the components via rgb (limited between 0 and 1)" );
}
{ //::SireMaths::MultiVector::set
typedef void ( ::SireMaths::MultiVector::*set_function_type)( ::SireMaths::MultiDouble const &,::SireMaths::MultiDouble const &,::SireMaths::MultiDouble const & ) ;
set_function_type set_function_value( &::SireMaths::MultiVector::set );
MultiVector_exposer.def(
"set"
, set_function_value
, ( bp::arg("x"), bp::arg("y"), bp::arg("z") )
, "Set individual values of the vector" );
}
{ //::SireMaths::MultiVector::set
typedef void ( ::SireMaths::MultiVector::*set_function_type)( int,::SireMaths::Vector const & ) ;
set_function_type set_function_value( &::SireMaths::MultiVector::set );
MultiVector_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("val") )
, "Set individual values of the vector" );
}
{ //::SireMaths::MultiVector::setB
typedef void ( ::SireMaths::MultiVector::*setB_function_type)( ::SireMaths::MultiDouble const & ) ;
setB_function_type setB_function_value( &::SireMaths::MultiVector::setB );
MultiVector_exposer.def(
"setB"
, setB_function_value
, ( bp::arg("val") )
, "Set individual values of the vector" );
}
{ //::SireMaths::MultiVector::setG
typedef void ( ::SireMaths::MultiVector::*setG_function_type)( ::SireMaths::MultiDouble const & ) ;
setG_function_type setG_function_value( &::SireMaths::MultiVector::setG );
MultiVector_exposer.def(
"setG"
, setG_function_value
, ( bp::arg("val") )
, "Set individual values of the vector" );
}
{ //::SireMaths::MultiVector::setMax
typedef void ( ::SireMaths::MultiVector::*setMax_function_type)( ::SireMaths::MultiVector const & ) ;
setMax_function_type setMax_function_value( &::SireMaths::MultiVector::setMax );
MultiVector_exposer.def(
"setMax"
, setMax_function_value
, ( bp::arg("other") )
, "Set this Vector so that it has the maximum xyz components out of\nthis and other (e.g. this->x = max(this->x(),other.x() etc.)" );
}
{ //::SireMaths::MultiVector::setMin
typedef void ( ::SireMaths::MultiVector::*setMin_function_type)( ::SireMaths::MultiVector const & ) ;
setMin_function_type setMin_function_value( &::SireMaths::MultiVector::setMin );
MultiVector_exposer.def(
"setMin"
, setMin_function_value
, ( bp::arg("other") )
, "Set this Vector so that it has the minimum xyz components" );
}
{ //::SireMaths::MultiVector::setR
typedef void ( ::SireMaths::MultiVector::*setR_function_type)( ::SireMaths::MultiDouble const & ) ;
setR_function_type setR_function_value( &::SireMaths::MultiVector::setR );
MultiVector_exposer.def(
"setR"
, setR_function_value
, ( bp::arg("val") )
, "Set individual values of the vector" );
}
{ //::SireMaths::MultiVector::setX
typedef void ( ::SireMaths::MultiVector::*setX_function_type)( ::SireMaths::MultiDouble const & ) ;
setX_function_type setX_function_value( &::SireMaths::MultiVector::setX );
MultiVector_exposer.def(
"setX"
, setX_function_value
, ( bp::arg("val") )
, "Set individual values of the vector" );
}
{ //::SireMaths::MultiVector::setY
typedef void ( ::SireMaths::MultiVector::*setY_function_type)( ::SireMaths::MultiDouble const & ) ;
setY_function_type setY_function_value( &::SireMaths::MultiVector::setY );
MultiVector_exposer.def(
"setY"
, setY_function_value
, ( bp::arg("val") )
, "Set individual values of the vector" );
}
{ //::SireMaths::MultiVector::setZ
typedef void ( ::SireMaths::MultiVector::*setZ_function_type)( ::SireMaths::MultiDouble const & ) ;
setZ_function_type setZ_function_value( &::SireMaths::MultiVector::setZ );
MultiVector_exposer.def(
"setZ"
, setZ_function_value
, ( bp::arg("val") )
, "Set individual values of the vector" );
}
{ //::SireMaths::MultiVector::size
typedef int ( *size_function_type )( );
size_function_type size_function_value( &::SireMaths::MultiVector::size );
MultiVector_exposer.def(
"size"
, size_function_value
, "Return the number of vectors in this MultiVector" );
}
{ //::SireMaths::MultiVector::swap
typedef void ( *swap_function_type )( ::SireMaths::MultiVector &,int,::SireMaths::MultiVector &,int );
swap_function_type swap_function_value( &::SireMaths::MultiVector::swap );
MultiVector_exposer.def(
"swap"
, swap_function_value
, ( bp::arg("v0"), bp::arg("idx0"), bp::arg("v1"), bp::arg("idx1") )
, "Swap the values of the value at index idx0 in f0 with the value at index idx in f1" );
}
{ //::SireMaths::MultiVector::toString
typedef ::QString ( ::SireMaths::MultiVector::*toString_function_type)( ) const;
toString_function_type toString_function_value( &::SireMaths::MultiVector::toString );
MultiVector_exposer.def(
"toString"
, toString_function_value
, "Return a QString representation of the vector" );
}
{ //::SireMaths::MultiVector::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMaths::MultiVector::typeName );
MultiVector_exposer.def(
"typeName"
, typeName_function_value
, "" );
}
{ //::SireMaths::MultiVector::what
typedef char const * ( ::SireMaths::MultiVector::*what_function_type)( ) const;
what_function_type what_function_value( &::SireMaths::MultiVector::what );
MultiVector_exposer.def(
"what"
, what_function_value
, "" );
}
{ //::SireMaths::MultiVector::x
typedef ::SireMaths::MultiDouble const & ( ::SireMaths::MultiVector::*x_function_type)( ) const;
x_function_type x_function_value( &::SireMaths::MultiVector::x );
MultiVector_exposer.def(
"x"
, x_function_value
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMaths::MultiVector::y
typedef ::SireMaths::MultiDouble const & ( ::SireMaths::MultiVector::*y_function_type)( ) const;
y_function_type y_function_value( &::SireMaths::MultiVector::y );
MultiVector_exposer.def(
"y"
, y_function_value
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMaths::MultiVector::z
typedef ::SireMaths::MultiDouble const & ( ::SireMaths::MultiVector::*z_function_type)( ) const;
z_function_type z_function_value( &::SireMaths::MultiVector::z );
MultiVector_exposer.def(
"z"
, z_function_value
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
MultiVector_exposer.staticmethod( "angle" );
MultiVector_exposer.staticmethod( "count" );
MultiVector_exposer.staticmethod( "cross" );
MultiVector_exposer.staticmethod( "dihedral" );
MultiVector_exposer.staticmethod( "distance" );
MultiVector_exposer.staticmethod( "distance2" );
MultiVector_exposer.staticmethod( "dot" );
MultiVector_exposer.staticmethod( "fromArray" );
MultiVector_exposer.staticmethod( "generate" );
MultiVector_exposer.staticmethod( "invDistance" );
MultiVector_exposer.staticmethod( "invDistance2" );
MultiVector_exposer.staticmethod( "size" );
MultiVector_exposer.staticmethod( "swap" );
MultiVector_exposer.staticmethod( "typeName" );
MultiVector_exposer.def( bp::self * bp::other< SireMaths::MultiDouble >() );
MultiVector_exposer.def( bp::self * bp::other< SireMaths::MultiQuaternion >() );
MultiVector_exposer.def( bp::self + bp::self );
MultiVector_exposer.def( bp::self - bp::self );
MultiVector_exposer.def( bp::self / bp::other< SireMaths::MultiDouble >() );
MultiVector_exposer.def( "__copy__", &__copy__);
MultiVector_exposer.def( "__deepcopy__", &__copy__);
MultiVector_exposer.def( "clone", &__copy__);
MultiVector_exposer.def( "__str__", &__str__< ::SireMaths::MultiVector > );
MultiVector_exposer.def( "__repr__", &__str__< ::SireMaths::MultiVector > );
MultiVector_exposer.def( "__len__", &__len_size< ::SireMaths::MultiVector > );
MultiVector_exposer.def( "__getitem__", &::SireMaths::MultiVector::getitem );
}
}
void register_GridPotentialTable_class(){
{ //::SireFF::GridPotentialTable
typedef bp::class_< SireFF::GridPotentialTable > GridPotentialTable_exposer_t;
GridPotentialTable_exposer_t GridPotentialTable_exposer = GridPotentialTable_exposer_t( "GridPotentialTable", bp::init< >() );
bp::scope GridPotentialTable_scope( GridPotentialTable_exposer );
GridPotentialTable_exposer.def( bp::init< SireVol::Grid const & >(( bp::arg("grid") )) );
GridPotentialTable_exposer.def( bp::init< SireFF::GridPotentialTable const & >(( bp::arg("other") )) );
{ //::SireFF::GridPotentialTable::add
typedef void ( ::SireFF::GridPotentialTable::*add_function_type )( int,::SireUnits::Dimension::MolarEnergy const & ) ;
add_function_type add_function_value( &::SireFF::GridPotentialTable::add );
GridPotentialTable_exposer.def(
"add"
, add_function_value
, ( bp::arg("ipoint"), bp::arg("potential") ) );
}
{ //::SireFF::GridPotentialTable::add
typedef void ( ::SireFF::GridPotentialTable::*add_function_type )( ::SireFF::GridPotentialTable const & ) ;
add_function_type add_function_value( &::SireFF::GridPotentialTable::add );
GridPotentialTable_exposer.def(
"add"
, add_function_value
, ( bp::arg("other") ) );
}
{ //::SireFF::GridPotentialTable::add
typedef void ( ::SireFF::GridPotentialTable::*add_function_type )( ::SireUnits::Dimension::MolarEnergy const & ) ;
add_function_type add_function_value( &::SireFF::GridPotentialTable::add );
GridPotentialTable_exposer.def(
"add"
, add_function_value
, ( bp::arg("potential") ) );
}
{ //::SireFF::GridPotentialTable::at
typedef ::SireUnits::Dimension::MolarEnergy const & ( ::SireFF::GridPotentialTable::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireFF::GridPotentialTable::at );
GridPotentialTable_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireFF::GridPotentialTable::count
typedef int ( ::SireFF::GridPotentialTable::*count_function_type )( ) const;
count_function_type count_function_value( &::SireFF::GridPotentialTable::count );
GridPotentialTable_exposer.def(
"count"
, count_function_value );
}
{ //::SireFF::GridPotentialTable::divide
typedef void ( ::SireFF::GridPotentialTable::*divide_function_type )( double ) ;
divide_function_type divide_function_value( &::SireFF::GridPotentialTable::divide );
GridPotentialTable_exposer.def(
"divide"
, divide_function_value
, ( bp::arg("value") ) );
}
{ //::SireFF::GridPotentialTable::grid
typedef ::SireVol::Grid const & ( ::SireFF::GridPotentialTable::*grid_function_type )( ) const;
grid_function_type grid_function_value( &::SireFF::GridPotentialTable::grid );
GridPotentialTable_exposer.def(
"grid"
, grid_function_value
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireFF::GridPotentialTable::initialise
typedef void ( ::SireFF::GridPotentialTable::*initialise_function_type )( ) ;
initialise_function_type initialise_function_value( &::SireFF::GridPotentialTable::initialise );
GridPotentialTable_exposer.def(
"initialise"
, initialise_function_value );
}
{ //::SireFF::GridPotentialTable::multiply
typedef void ( ::SireFF::GridPotentialTable::*multiply_function_type )( double ) ;
multiply_function_type multiply_function_value( &::SireFF::GridPotentialTable::multiply );
GridPotentialTable_exposer.def(
"multiply"
, multiply_function_value
, ( bp::arg("value") ) );
}
{ //::SireFF::GridPotentialTable::nPoints
typedef int ( ::SireFF::GridPotentialTable::*nPoints_function_type )( ) const;
nPoints_function_type nPoints_function_value( &::SireFF::GridPotentialTable::nPoints );
GridPotentialTable_exposer.def(
"nPoints"
, nPoints_function_value );
}
GridPotentialTable_exposer.def( bp::self != bp::self );
GridPotentialTable_exposer.def( bp::self * bp::other< double >() );
GridPotentialTable_exposer.def( bp::self + bp::self );
GridPotentialTable_exposer.def( bp::self + bp::other< SireUnits::Dimension::PhysUnit< 1, 2, -2, 0, 0, -1, 0 > >() );
GridPotentialTable_exposer.def( bp::self - bp::self );
GridPotentialTable_exposer.def( bp::self - bp::other< SireUnits::Dimension::PhysUnit< 1, 2, -2, 0, 0, -1, 0 > >() );
GridPotentialTable_exposer.def( -bp::self );
GridPotentialTable_exposer.def( bp::self / bp::other< double >() );
{ //::SireFF::GridPotentialTable::operator=
typedef ::SireFF::GridPotentialTable & ( ::SireFF::GridPotentialTable::*assign_function_type )( ::SireFF::GridPotentialTable const & ) ;
assign_function_type assign_function_value( &::SireFF::GridPotentialTable::operator= );
GridPotentialTable_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
{ //::SireFF::GridPotentialTable::operator=
typedef ::SireFF::GridPotentialTable & ( ::SireFF::GridPotentialTable::*assign_function_type )( ::SireUnits::Dimension::MolarEnergy const & ) ;
assign_function_type assign_function_value( &::SireFF::GridPotentialTable::operator= );
GridPotentialTable_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("potential") )
, bp::return_self< >() );
}
GridPotentialTable_exposer.def( bp::self == bp::self );
{ //::SireFF::GridPotentialTable::operator[]
typedef ::SireUnits::Dimension::MolarEnergy & ( ::SireFF::GridPotentialTable::*__getitem___function_type )( int ) ;
__getitem___function_type __getitem___function_value( &::SireFF::GridPotentialTable::operator[] );
GridPotentialTable_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_internal_reference< >() );
}
{ //::SireFF::GridPotentialTable::operator[]
typedef ::SireUnits::Dimension::MolarEnergy const & ( ::SireFF::GridPotentialTable::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireFF::GridPotentialTable::operator[] );
GridPotentialTable_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireFF::GridPotentialTable::setAll
typedef void ( ::SireFF::GridPotentialTable::*setAll_function_type )( ::SireUnits::Dimension::MolarEnergy const & ) ;
setAll_function_type setAll_function_value( &::SireFF::GridPotentialTable::setAll );
GridPotentialTable_exposer.def(
"setAll"
, setAll_function_value
, ( bp::arg("potential") ) );
}
{ //::SireFF::GridPotentialTable::subtract
typedef void ( ::SireFF::GridPotentialTable::*subtract_function_type )( int,::SireUnits::Dimension::MolarEnergy const & ) ;
subtract_function_type subtract_function_value( &::SireFF::GridPotentialTable::subtract );
GridPotentialTable_exposer.def(
"subtract"
, subtract_function_value
, ( bp::arg("ipoint"), bp::arg("potential") ) );
}
{ //::SireFF::GridPotentialTable::subtract
typedef void ( ::SireFF::GridPotentialTable::*subtract_function_type )( ::SireFF::GridPotentialTable const & ) ;
subtract_function_type subtract_function_value( &::SireFF::GridPotentialTable::subtract );
GridPotentialTable_exposer.def(
"subtract"
, subtract_function_value
, ( bp::arg("other") ) );
}
{ //::SireFF::GridPotentialTable::subtract
typedef void ( ::SireFF::GridPotentialTable::*subtract_function_type )( ::SireUnits::Dimension::MolarEnergy const & ) ;
subtract_function_type subtract_function_value( &::SireFF::GridPotentialTable::subtract );
GridPotentialTable_exposer.def(
"subtract"
, subtract_function_value
, ( bp::arg("potential") ) );
}
{ //::SireFF::GridPotentialTable::toVector
typedef ::QVector< SireUnits::Dimension::PhysUnit< 1, 2, -2, 0, 0, -1, 0 > > ( ::SireFF::GridPotentialTable::*toVector_function_type )( ) const;
toVector_function_type toVector_function_value( &::SireFF::GridPotentialTable::toVector );
GridPotentialTable_exposer.def(
"toVector"
, toVector_function_value );
}
{ //::SireFF::GridPotentialTable::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireFF::GridPotentialTable::typeName );
GridPotentialTable_exposer.def(
"typeName"
, typeName_function_value );
}
GridPotentialTable_exposer.staticmethod( "typeName" );
GridPotentialTable_exposer.def( "__copy__", &__copy__);
GridPotentialTable_exposer.def( "__deepcopy__", &__copy__);
GridPotentialTable_exposer.def( "clone", &__copy__);
GridPotentialTable_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireFF::GridPotentialTable >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
GridPotentialTable_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireFF::GridPotentialTable >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
GridPotentialTable_exposer.def( "__str__", &pvt_get_name);
GridPotentialTable_exposer.def( "__repr__", &pvt_get_name);
GridPotentialTable_exposer.def( "__len__", &__len_count< ::SireFF::GridPotentialTable > );
}
}
void register_TrigArray2D_double__class(){
{ //::SireBase::TrigArray2D< double >
typedef bp::class_< SireBase::TrigArray2D< double >, bp::bases< SireBase::TrigArray2DBase > > TrigArray2D_double__exposer_t;
TrigArray2D_double__exposer_t TrigArray2D_double__exposer = TrigArray2D_double__exposer_t( "TrigArray2D_double_", bp::init< >() );
bp::scope TrigArray2D_double__scope( TrigArray2D_double__exposer );
TrigArray2D_double__exposer.def( bp::init< int >(( bp::arg("dimension") )) );
TrigArray2D_double__exposer.def( bp::init< int, double const & >(( bp::arg("dimension"), bp::arg("default_value") )) );
TrigArray2D_double__exposer.def( bp::init< SireBase::TrigArray2D< double > const & >(( bp::arg("other") )) );
{ //::SireBase::TrigArray2D< double >::at
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef double const & ( ::SireBase::TrigArray2D< double >::*at_function_type )( int,int ) const;
at_function_type at_function_value( &::SireBase::TrigArray2D< double >::at );
TrigArray2D_double__exposer.def(
"at"
, at_function_value
, ( bp::arg("i"), bp::arg("j") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::TrigArray2D< double >::get
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef double const & ( ::SireBase::TrigArray2D< double >::*get_function_type )( int,int ) const;
get_function_type get_function_value( &::SireBase::TrigArray2D< double >::get );
TrigArray2D_double__exposer.def(
"get"
, get_function_value
, ( bp::arg("i"), bp::arg("j") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
TrigArray2D_double__exposer.def( bp::self != bp::self );
{ //::SireBase::TrigArray2D< double >::operator()
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef double const & ( ::SireBase::TrigArray2D< double >::*__call___function_type )( int,int ) const;
__call___function_type __call___function_value( &::SireBase::TrigArray2D< double >::operator() );
TrigArray2D_double__exposer.def(
"__call__"
, __call___function_value
, ( bp::arg("i"), bp::arg("j") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::TrigArray2D< double >::operator=
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef ::SireBase::TrigArray2D< double > & ( ::SireBase::TrigArray2D< double >::*assign_function_type )( ::SireBase::TrigArray2D< double > const & ) ;
assign_function_type assign_function_value( &::SireBase::TrigArray2D< double >::operator= );
TrigArray2D_double__exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
TrigArray2D_double__exposer.def( bp::self == bp::self );
{ //::SireBase::TrigArray2D< double >::redimension
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef void ( ::SireBase::TrigArray2D< double >::*redimension_function_type )( int ) ;
redimension_function_type redimension_function_value( &::SireBase::TrigArray2D< double >::redimension );
TrigArray2D_double__exposer.def(
"redimension"
, redimension_function_value
, ( bp::arg("dimension") ) );
}
{ //::SireBase::TrigArray2D< double >::set
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef void ( ::SireBase::TrigArray2D< double >::*set_function_type )( int,int,double const & ) ;
set_function_type set_function_value( &::SireBase::TrigArray2D< double >::set );
TrigArray2D_double__exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("j"), bp::arg("value") ) );
}
{ //::SireBase::TrigArray2D< double >::setAll
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef void ( ::SireBase::TrigArray2D< double >::*setAll_function_type )( double const & ) ;
setAll_function_type setAll_function_value( &::SireBase::TrigArray2D< double >::setAll );
TrigArray2D_double__exposer.def(
"setAll"
, setAll_function_value
, ( bp::arg("value") ) );
}
{ //::SireBase::TrigArray2D< double >::toString
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef ::QString ( ::SireBase::TrigArray2D< double >::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireBase::TrigArray2D< double >::toString );
TrigArray2D_double__exposer.def(
"toString"
, toString_function_value );
}
{ //::SireBase::TrigArray2D< double >::transpose
typedef SireBase::TrigArray2D< double > exported_class_t;
typedef ::SireBase::TrigArray2D< double > ( ::SireBase::TrigArray2D< double >::*transpose_function_type )( ) const;
transpose_function_type transpose_function_value( &::SireBase::TrigArray2D< double >::transpose );
TrigArray2D_double__exposer.def(
"transpose"
, transpose_function_value );
}
TrigArray2D_double__exposer.def( "__copy__", &__copy__);
TrigArray2D_double__exposer.def( "__deepcopy__", &__copy__);
TrigArray2D_double__exposer.def( "clone", &__copy__);
TrigArray2D_double__exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireBase::TrigArray2D<double> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
TrigArray2D_double__exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireBase::TrigArray2D<double> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
TrigArray2D_double__exposer.def( "__str__", &__str__< ::SireBase::TrigArray2D<double> > );
TrigArray2D_double__exposer.def( "__repr__", &__str__< ::SireBase::TrigArray2D<double> > );
TrigArray2D_double__exposer.def( "__len__", &__len_size< ::SireBase::TrigArray2D<double> > );
}
}
void register_Triangle_class() {
{ //::SireMaths::Triangle
typedef bp::class_< SireMaths::Triangle > Triangle_exposer_t;
Triangle_exposer_t Triangle_exposer = Triangle_exposer_t( "Triangle", bp::init< >() );
bp::scope Triangle_scope( Triangle_exposer );
Triangle_exposer.def( bp::init< SireMaths::Vector const &, SireMaths::Vector const &, SireMaths::Vector const & >(( bp::arg("point0"), bp::arg("point1"), bp::arg("point2") )) );
Triangle_exposer.def( bp::init< SireMaths::Triangle const & >(( bp::arg("other") )) );
{ //::SireMaths::Triangle::angle
typedef ::SireUnits::Dimension::Angle ( ::SireMaths::Triangle::*angle_function_type )( ) const;
angle_function_type angle_function_value( &::SireMaths::Triangle::angle );
Triangle_exposer.def(
"angle"
, angle_function_value );
}
{ //::SireMaths::Triangle::angle0
typedef ::SireUnits::Dimension::Angle ( ::SireMaths::Triangle::*angle0_function_type )( ) const;
angle0_function_type angle0_function_value( &::SireMaths::Triangle::angle0 );
Triangle_exposer.def(
"angle0"
, angle0_function_value );
}
{ //::SireMaths::Triangle::angle1
typedef ::SireUnits::Dimension::Angle ( ::SireMaths::Triangle::*angle1_function_type )( ) const;
angle1_function_type angle1_function_value( &::SireMaths::Triangle::angle1 );
Triangle_exposer.def(
"angle1"
, angle1_function_value );
}
{ //::SireMaths::Triangle::angle2
typedef ::SireUnits::Dimension::Angle ( ::SireMaths::Triangle::*angle2_function_type )( ) const;
angle2_function_type angle2_function_value( &::SireMaths::Triangle::angle2 );
Triangle_exposer.def(
"angle2"
, angle2_function_value );
}
{ //::SireMaths::Triangle::at
typedef ::SireMaths::Vector const & ( ::SireMaths::Triangle::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireMaths::Triangle::at );
Triangle_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMaths::Triangle::count
typedef int ( ::SireMaths::Triangle::*count_function_type )( ) const;
count_function_type count_function_value( &::SireMaths::Triangle::count );
Triangle_exposer.def(
"count"
, count_function_value );
}
{ //::SireMaths::Triangle::line0
typedef ::SireMaths::Line ( ::SireMaths::Triangle::*line0_function_type )( ) const;
line0_function_type line0_function_value( &::SireMaths::Triangle::line0 );
Triangle_exposer.def(
"line0"
, line0_function_value );
}
{ //::SireMaths::Triangle::line1
typedef ::SireMaths::Line ( ::SireMaths::Triangle::*line1_function_type )( ) const;
line1_function_type line1_function_value( &::SireMaths::Triangle::line1 );
Triangle_exposer.def(
"line1"
, line1_function_value );
}
{ //::SireMaths::Triangle::line2
typedef ::SireMaths::Line ( ::SireMaths::Triangle::*line2_function_type )( ) const;
line2_function_type line2_function_value( &::SireMaths::Triangle::line2 );
Triangle_exposer.def(
"line2"
, line2_function_value );
}
{ //::SireMaths::Triangle::operator[]
typedef ::SireMaths::Vector const & ( ::SireMaths::Triangle::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireMaths::Triangle::operator[] );
Triangle_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMaths::Triangle::point
typedef ::SireMaths::Vector const & ( ::SireMaths::Triangle::*point_function_type )( int ) const;
point_function_type point_function_value( &::SireMaths::Triangle::point );
Triangle_exposer.def(
"point"
, point_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMaths::Triangle::toString
typedef ::QString ( ::SireMaths::Triangle::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireMaths::Triangle::toString );
Triangle_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireMaths::Triangle::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMaths::Triangle::typeName );
Triangle_exposer.def(
"typeName"
, typeName_function_value );
}
{ //::SireMaths::Triangle::vector
typedef ::SireMaths::Vector ( ::SireMaths::Triangle::*vector_function_type )( ) const;
vector_function_type vector_function_value( &::SireMaths::Triangle::vector );
Triangle_exposer.def(
"vector"
, vector_function_value );
}
{ //::SireMaths::Triangle::vector0
typedef ::SireMaths::Vector ( ::SireMaths::Triangle::*vector0_function_type )( ) const;
vector0_function_type vector0_function_value( &::SireMaths::Triangle::vector0 );
Triangle_exposer.def(
"vector0"
, vector0_function_value );
}
{ //::SireMaths::Triangle::vector1
typedef ::SireMaths::Vector ( ::SireMaths::Triangle::*vector1_function_type )( ) const;
vector1_function_type vector1_function_value( &::SireMaths::Triangle::vector1 );
Triangle_exposer.def(
"vector1"
, vector1_function_value );
}
{ //::SireMaths::Triangle::vector2
typedef ::SireMaths::Vector ( ::SireMaths::Triangle::*vector2_function_type )( ) const;
vector2_function_type vector2_function_value( &::SireMaths::Triangle::vector2 );
Triangle_exposer.def(
"vector2"
, vector2_function_value );
}
{ //::SireMaths::Triangle::what
typedef char const * ( ::SireMaths::Triangle::*what_function_type )( ) const;
what_function_type what_function_value( &::SireMaths::Triangle::what );
Triangle_exposer.def(
"what"
, what_function_value );
}
Triangle_exposer.staticmethod( "typeName" );
Triangle_exposer.def( "__copy__", &__copy__);
Triangle_exposer.def( "__deepcopy__", &__copy__);
Triangle_exposer.def( "clone", &__copy__);
Triangle_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMaths::Triangle >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Triangle_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMaths::Triangle >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Triangle_exposer.def( "__str__", &__str__< ::SireMaths::Triangle > );
Triangle_exposer.def( "__repr__", &__str__< ::SireMaths::Triangle > );
Triangle_exposer.def( "__len__", &__len_count< ::SireMaths::Triangle > );
}
}
void register_CLJBoxes_class(){
{ //::SireMM::CLJBoxes
typedef bp::class_< SireMM::CLJBoxes > CLJBoxes_exposer_t;
CLJBoxes_exposer_t CLJBoxes_exposer = CLJBoxes_exposer_t( "CLJBoxes", bp::init< >() );
bp::scope CLJBoxes_scope( CLJBoxes_exposer );
CLJBoxes_exposer.def( bp::init< SireUnits::Dimension::Length >(( bp::arg("box_size") )) );
CLJBoxes_exposer.def( bp::init< SireMM::CLJAtoms const & >(( bp::arg("atoms") )) );
CLJBoxes_exposer.def( bp::init< SireMM::CLJAtoms const &, SireMM::CLJAtoms const & >(( bp::arg("atoms0"), bp::arg("atoms1") )) );
CLJBoxes_exposer.def( bp::init< SireMM::CLJAtoms const &, SireUnits::Dimension::Length >(( bp::arg("atoms"), bp::arg("box_size") )) );
CLJBoxes_exposer.def( bp::init< SireMM::CLJAtoms const &, SireMM::CLJAtoms const &, SireUnits::Dimension::Length >(( bp::arg("atoms0"), bp::arg("atoms1"), bp::arg("box_size") )) );
CLJBoxes_exposer.def( bp::init< SireMM::CLJBoxes const & >(( bp::arg("other") )) );
{ //::SireMM::CLJBoxes::add
typedef ::QVector< SireMM::CLJBoxIndex > ( ::SireMM::CLJBoxes::*add_function_type )( ::SireMM::CLJAtoms const & ) ;
add_function_type add_function_value( &::SireMM::CLJBoxes::add );
CLJBoxes_exposer.def(
"add"
, add_function_value
, ( bp::arg("atoms") ) );
}
{ //::SireMM::CLJBoxes::at
typedef ::SireMM::CLJAtom ( ::SireMM::CLJBoxes::*at_function_type )( ::SireMM::CLJBoxIndex const & ) const;
at_function_type at_function_value( &::SireMM::CLJBoxes::at );
CLJBoxes_exposer.def(
"at"
, at_function_value
, ( bp::arg("idx") ) );
}
{ //::SireMM::CLJBoxes::atoms
typedef ::SireMM::CLJAtoms ( ::SireMM::CLJBoxes::*atoms_function_type )( ) const;
atoms_function_type atoms_function_value( &::SireMM::CLJBoxes::atoms );
CLJBoxes_exposer.def(
"atoms"
, atoms_function_value );
}
{ //::SireMM::CLJBoxes::atoms
typedef ::SireMM::CLJAtoms ( ::SireMM::CLJBoxes::*atoms_function_type )( ::QVector< SireMM::CLJBoxIndex > const & ) const;
atoms_function_type atoms_function_value( &::SireMM::CLJBoxes::atoms );
CLJBoxes_exposer.def(
"atoms"
, atoms_function_value
, ( bp::arg("atoms") ) );
}
{ //::SireMM::CLJBoxes::boxAt
typedef ::SireMM::CLJBox ( ::SireMM::CLJBoxes::*boxAt_function_type )( int ) const;
boxAt_function_type boxAt_function_value( &::SireMM::CLJBoxes::boxAt );
CLJBoxes_exposer.def(
"boxAt"
, boxAt_function_value
, ( bp::arg("i") ) );
}
{ //::SireMM::CLJBoxes::boxAt
typedef ::SireMM::CLJBox ( ::SireMM::CLJBoxes::*boxAt_function_type )( ::SireMM::CLJBoxIndex const & ) const;
boxAt_function_type boxAt_function_value( &::SireMM::CLJBoxes::boxAt );
CLJBoxes_exposer.def(
"boxAt"
, boxAt_function_value
, ( bp::arg("index") ) );
}
{ //::SireMM::CLJBoxes::boxAt
typedef ::SireMM::CLJBox ( ::SireMM::CLJBoxes::*boxAt_function_type )( ::SireMaths::Vector const & ) const;
boxAt_function_type boxAt_function_value( &::SireMM::CLJBoxes::boxAt );
CLJBoxes_exposer.def(
"boxAt"
, boxAt_function_value
, ( bp::arg("coords") ) );
}
{ //::SireMM::CLJBoxes::boxDimensions
typedef ::QVector< SireVol::AABox > ( ::SireMM::CLJBoxes::*boxDimensions_function_type )( ) const;
boxDimensions_function_type boxDimensions_function_value( &::SireMM::CLJBoxes::boxDimensions );
CLJBoxes_exposer.def(
"boxDimensions"
, boxDimensions_function_value );
}
{ //::SireMM::CLJBoxes::boxDimensionsAt
typedef ::SireVol::AABox ( ::SireMM::CLJBoxes::*boxDimensionsAt_function_type )( int ) const;
boxDimensionsAt_function_type boxDimensionsAt_function_value( &::SireMM::CLJBoxes::boxDimensionsAt );
CLJBoxes_exposer.def(
"boxDimensionsAt"
, boxDimensionsAt_function_value
, ( bp::arg("i") ) );
}
{ //::SireMM::CLJBoxes::boxDimensionsAt
typedef ::SireVol::AABox ( ::SireMM::CLJBoxes::*boxDimensionsAt_function_type )( ::SireMM::CLJBoxIndex const & ) const;
boxDimensionsAt_function_type boxDimensionsAt_function_value( &::SireMM::CLJBoxes::boxDimensionsAt );
CLJBoxes_exposer.def(
"boxDimensionsAt"
, boxDimensionsAt_function_value
, ( bp::arg("index") ) );
}
{ //::SireMM::CLJBoxes::boxDimensionsAt
typedef ::SireVol::AABox ( ::SireMM::CLJBoxes::*boxDimensionsAt_function_type )( ::SireMaths::Vector const & ) const;
boxDimensionsAt_function_type boxDimensionsAt_function_value( &::SireMM::CLJBoxes::boxDimensionsAt );
CLJBoxes_exposer.def(
"boxDimensionsAt"
, boxDimensionsAt_function_value
, ( bp::arg("coords") ) );
}
{ //::SireMM::CLJBoxes::boxes
typedef ::QVector< SireMM::CLJBox > ( ::SireMM::CLJBoxes::*boxes_function_type )( ) const;
boxes_function_type boxes_function_value( &::SireMM::CLJBoxes::boxes );
CLJBoxes_exposer.def(
"boxes"
, boxes_function_value );
}
{ //::SireMM::CLJBoxes::get
typedef ::SireMM::CLJAtoms ( ::SireMM::CLJBoxes::*get_function_type )( ::QVector< SireMM::CLJBoxIndex > const & ) const;
get_function_type get_function_value( &::SireMM::CLJBoxes::get );
CLJBoxes_exposer.def(
"get"
, get_function_value
, ( bp::arg("atoms") ) );
}
{ //::SireMM::CLJBoxes::getDistance
typedef float ( ::SireMM::CLJBoxes::*getDistance_function_type )( ::SireMM::CLJBoxIndex const &,::SireMM::CLJBoxIndex const & ) const;
getDistance_function_type getDistance_function_value( &::SireMM::CLJBoxes::getDistance );
CLJBoxes_exposer.def(
"getDistance"
, getDistance_function_value
, ( bp::arg("box0"), bp::arg("box1") ) );
}
{ //::SireMM::CLJBoxes::getDistance
typedef float ( ::SireMM::CLJBoxes::*getDistance_function_type )( ::SireVol::Space const &,::SireMM::CLJBoxIndex const &,::SireMM::CLJBoxIndex const & ) const;
getDistance_function_type getDistance_function_value( &::SireMM::CLJBoxes::getDistance );
CLJBoxes_exposer.def(
"getDistance"
, getDistance_function_value
, ( bp::arg("space"), bp::arg("box0"), bp::arg("box1") ) );
}
{ //::SireMM::CLJBoxes::getDistance
typedef float ( ::SireMM::CLJBoxes::*getDistance_function_type )( ::SireVol::Space const &,::SireMM::CLJBoxIndex const &,::SireMM::CLJBoxIndex const &,::quint32,::quint32,::quint32 ) const;
getDistance_function_type getDistance_function_value( &::SireMM::CLJBoxes::getDistance );
CLJBoxes_exposer.def(
"getDistance"
, getDistance_function_value
, ( bp::arg("space"), bp::arg("box0"), bp::arg("box1"), bp::arg("nx"), bp::arg("ny"), bp::arg("nz") ) );
}
{ //::SireMM::CLJBoxes::getDistances
typedef ::QVector< SireMM::CLJBoxDistance > ( *getDistances_function_type )( ::SireVol::Space const &,::SireMM::CLJBoxes const & );
getDistances_function_type getDistances_function_value( &::SireMM::CLJBoxes::getDistances );
CLJBoxes_exposer.def(
"getDistances"
, getDistances_function_value
, ( bp::arg("space"), bp::arg("boxes") ) );
}
{ //::SireMM::CLJBoxes::getDistances
typedef ::QVector< SireMM::CLJBoxDistance > ( *getDistances_function_type )( ::SireVol::Space const &,::SireMM::CLJBoxes const &,::SireUnits::Dimension::Length );
getDistances_function_type getDistances_function_value( &::SireMM::CLJBoxes::getDistances );
CLJBoxes_exposer.def(
"getDistances"
, getDistances_function_value
, ( bp::arg("space"), bp::arg("boxes"), bp::arg("cutoff") ) );
}
{ //::SireMM::CLJBoxes::getDistances
typedef ::QVector< SireMM::CLJBoxDistance > ( *getDistances_function_type )( ::SireVol::Space const &,::SireMM::CLJBoxes const &,::SireMM::CLJBoxes const & );
getDistances_function_type getDistances_function_value( &::SireMM::CLJBoxes::getDistances );
CLJBoxes_exposer.def(
"getDistances"
, getDistances_function_value
, ( bp::arg("space"), bp::arg("boxes0"), bp::arg("boxes1") ) );
}
{ //::SireMM::CLJBoxes::getDistances
typedef ::QVector< SireMM::CLJBoxDistance > ( *getDistances_function_type )( ::SireVol::Space const &,::SireMM::CLJBoxes const &,::SireMM::CLJBoxes const &,::SireUnits::Dimension::Length );
getDistances_function_type getDistances_function_value( &::SireMM::CLJBoxes::getDistances );
CLJBoxes_exposer.def(
"getDistances"
, getDistances_function_value
, ( bp::arg("space"), bp::arg("boxes0"), bp::arg("boxes1"), bp::arg("cutoff") ) );
}
{ //::SireMM::CLJBoxes::getDistances
typedef ::QVector< SireMM::CLJBoxDistance > ( *getDistances_function_type )( ::SireVol::Space const &,::SireMM::CLJAtoms const &,::SireMM::CLJBoxes const & );
getDistances_function_type getDistances_function_value( &::SireMM::CLJBoxes::getDistances );
CLJBoxes_exposer.def(
"getDistances"
, getDistances_function_value
, ( bp::arg("space"), bp::arg("atoms0"), bp::arg("boxes1") ) );
}
{ //::SireMM::CLJBoxes::getDistances
typedef ::QVector< SireMM::CLJBoxDistance > ( *getDistances_function_type )( ::SireVol::Space const &,::SireMM::CLJAtoms const &,::SireMM::CLJBoxes const &,::SireUnits::Dimension::Length );
getDistances_function_type getDistances_function_value( &::SireMM::CLJBoxes::getDistances );
CLJBoxes_exposer.def(
"getDistances"
, getDistances_function_value
, ( bp::arg("space"), bp::arg("atoms0"), bp::arg("boxes1"), bp::arg("cutoff") ) );
}
{ //::SireMM::CLJBoxes::getitem
typedef ::SireMM::CLJAtom ( ::SireMM::CLJBoxes::*getitem_function_type )( ::SireMM::CLJBoxIndex const & ) const;
getitem_function_type getitem_function_value( &::SireMM::CLJBoxes::getitem );
CLJBoxes_exposer.def(
"getitem"
, getitem_function_value
, ( bp::arg("idx") ) );
}
{ //::SireMM::CLJBoxes::isEmpty
typedef bool ( ::SireMM::CLJBoxes::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireMM::CLJBoxes::isEmpty );
CLJBoxes_exposer.def(
"isEmpty"
, isEmpty_function_value );
}
{ //::SireMM::CLJBoxes::length
typedef ::SireUnits::Dimension::Length ( ::SireMM::CLJBoxes::*length_function_type )( ) const;
length_function_type length_function_value( &::SireMM::CLJBoxes::length );
CLJBoxes_exposer.def(
"length"
, length_function_value );
}
{ //::SireMM::CLJBoxes::nAtoms
typedef int ( ::SireMM::CLJBoxes::*nAtoms_function_type )( ) const;
nAtoms_function_type nAtoms_function_value( &::SireMM::CLJBoxes::nAtoms );
CLJBoxes_exposer.def(
"nAtoms"
, nAtoms_function_value );
}
{ //::SireMM::CLJBoxes::nOccupiedBoxes
typedef int ( ::SireMM::CLJBoxes::*nOccupiedBoxes_function_type )( ) const;
nOccupiedBoxes_function_type nOccupiedBoxes_function_value( &::SireMM::CLJBoxes::nOccupiedBoxes );
CLJBoxes_exposer.def(
"nOccupiedBoxes"
, nOccupiedBoxes_function_value );
}
{ //::SireMM::CLJBoxes::occupiedBoxIndicies
typedef ::QVector< SireMM::CLJBoxIndex > ( ::SireMM::CLJBoxes::*occupiedBoxIndicies_function_type )( ) const;
occupiedBoxIndicies_function_type occupiedBoxIndicies_function_value( &::SireMM::CLJBoxes::occupiedBoxIndicies );
CLJBoxes_exposer.def(
"occupiedBoxIndicies"
, occupiedBoxIndicies_function_value );
}
{ //::SireMM::CLJBoxes::occupiedBoxes
typedef ::QVector< SireMM::CLJBoxPtr > const & ( ::SireMM::CLJBoxes::*occupiedBoxes_function_type )( ) const;
occupiedBoxes_function_type occupiedBoxes_function_value( &::SireMM::CLJBoxes::occupiedBoxes );
CLJBoxes_exposer.def(
"occupiedBoxes"
, occupiedBoxes_function_value
, bp::return_value_policy< bp::copy_const_reference >() );
}
CLJBoxes_exposer.def( bp::self != bp::self );
CLJBoxes_exposer.def( bp::self + bp::self );
{ //::SireMM::CLJBoxes::operator=
typedef ::SireMM::CLJBoxes & ( ::SireMM::CLJBoxes::*assign_function_type )( ::SireMM::CLJBoxes const & ) ;
assign_function_type assign_function_value( &::SireMM::CLJBoxes::operator= );
CLJBoxes_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
CLJBoxes_exposer.def( bp::self == bp::self );
{ //::SireMM::CLJBoxes::operator[]
typedef ::SireMM::CLJAtom ( ::SireMM::CLJBoxes::*__getitem___function_type )( ::SireMM::CLJBoxIndex const & ) const;
__getitem___function_type __getitem___function_value( &::SireMM::CLJBoxes::operator[] );
CLJBoxes_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("idx") ) );
}
{ //::SireMM::CLJBoxes::remove
typedef void ( ::SireMM::CLJBoxes::*remove_function_type )( ::QVector< SireMM::CLJBoxIndex > const & ) ;
remove_function_type remove_function_value( &::SireMM::CLJBoxes::remove );
CLJBoxes_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("atoms") ) );
}
{ //::SireMM::CLJBoxes::squeeze
typedef ::SireMM::CLJBoxes ( ::SireMM::CLJBoxes::*squeeze_function_type )( ) const;
squeeze_function_type squeeze_function_value( &::SireMM::CLJBoxes::squeeze );
CLJBoxes_exposer.def(
"squeeze"
, squeeze_function_value );
}
{ //::SireMM::CLJBoxes::take
typedef ::SireMM::CLJAtoms ( ::SireMM::CLJBoxes::*take_function_type )( ::QVector< SireMM::CLJBoxIndex > const & ) ;
take_function_type take_function_value( &::SireMM::CLJBoxes::take );
CLJBoxes_exposer.def(
"take"
, take_function_value
, ( bp::arg("atoms") ) );
}
{ //::SireMM::CLJBoxes::toString
typedef ::QString ( ::SireMM::CLJBoxes::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireMM::CLJBoxes::toString );
CLJBoxes_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireMM::CLJBoxes::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMM::CLJBoxes::typeName );
CLJBoxes_exposer.def(
"typeName"
, typeName_function_value );
}
{ //::SireMM::CLJBoxes::what
typedef char const * ( ::SireMM::CLJBoxes::*what_function_type )( ) const;
what_function_type what_function_value( &::SireMM::CLJBoxes::what );
CLJBoxes_exposer.def(
"what"
, what_function_value );
}
CLJBoxes_exposer.staticmethod( "getDistances" );
CLJBoxes_exposer.staticmethod( "typeName" );
CLJBoxes_exposer.def( "__copy__", &__copy__);
CLJBoxes_exposer.def( "__deepcopy__", &__copy__);
CLJBoxes_exposer.def( "clone", &__copy__);
CLJBoxes_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMM::CLJBoxes >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
CLJBoxes_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMM::CLJBoxes >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
CLJBoxes_exposer.def( "__str__", &__str__< ::SireMM::CLJBoxes > );
CLJBoxes_exposer.def( "__repr__", &__str__< ::SireMM::CLJBoxes > );
CLJBoxes_exposer.def( "__getitem__", &::SireMM::CLJBoxes::getitem );
}
}
void register_Array2D_SireMaths_AccumulatorPtr__class(){
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >
typedef bp::class_< SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >, bp::bases< SireBase::Array2DBase > > Array2D_SireMaths_AccumulatorPtr__exposer_t;
Array2D_SireMaths_AccumulatorPtr__exposer_t Array2D_SireMaths_AccumulatorPtr__exposer = Array2D_SireMaths_AccumulatorPtr__exposer_t( "Array2D_SireMaths_AccumulatorPtr_", bp::init< >() );
bp::scope Array2D_SireMaths_AccumulatorPtr__scope( Array2D_SireMaths_AccumulatorPtr__exposer );
Array2D_SireMaths_AccumulatorPtr__exposer.def( bp::init< int, int >(( bp::arg("nrows"), bp::arg("ncolumns") )) );
Array2D_SireMaths_AccumulatorPtr__exposer.def( bp::init< int, int, SireBase::PropPtr< SireMaths::Accumulator > const & >(( bp::arg("nrows"), bp::arg("ncolumns"), bp::arg("default_value") )) );
Array2D_SireMaths_AccumulatorPtr__exposer.def( bp::init< SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > const & >(( bp::arg("other") )) );
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::at
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef ::SireBase::PropPtr< SireMaths::Accumulator > const & ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*at_function_type )( int,int ) const;
at_function_type at_function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::at );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"at"
, at_function_value
, ( bp::arg("i"), bp::arg("j") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::get
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef ::SireBase::PropPtr< SireMaths::Accumulator > const & ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*get_function_type )( int,int ) const;
get_function_type get_function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::get );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"get"
, get_function_value
, ( bp::arg("i"), bp::arg("j") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
Array2D_SireMaths_AccumulatorPtr__exposer.def( bp::self != bp::self );
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::operator()
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef ::SireBase::PropPtr< SireMaths::Accumulator > const & ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*__call___function_type )( int,int ) const;
__call___function_type __call___function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::operator() );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"__call__"
, __call___function_value
, ( bp::arg("i"), bp::arg("j") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::operator=
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > & ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*assign_function_type )( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > const & ) ;
assign_function_type assign_function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::operator= );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
Array2D_SireMaths_AccumulatorPtr__exposer.def( bp::self == bp::self );
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::redimension
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef void ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*redimension_function_type )( int,int ) ;
redimension_function_type redimension_function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::redimension );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"redimension"
, redimension_function_value
, ( bp::arg("nrows"), bp::arg("ncolumns") ) );
}
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::set
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef void ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*set_function_type )( int,int,::SireBase::PropPtr< SireMaths::Accumulator > const & ) ;
set_function_type set_function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::set );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("j"), bp::arg("value") ) );
}
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::setAll
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef void ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*setAll_function_type )( ::SireBase::PropPtr< SireMaths::Accumulator > const & ) ;
setAll_function_type setAll_function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::setAll );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"setAll"
, setAll_function_value
, ( bp::arg("value") ) );
}
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::toString
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef ::QString ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::toString );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"toString"
, toString_function_value );
}
{ //::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::transpose
typedef SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > exported_class_t;
typedef ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > > ( ::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::*transpose_function_type )( ) const;
transpose_function_type transpose_function_value( &::SireBase::Array2D< SireBase::PropPtr< SireMaths::Accumulator > >::transpose );
Array2D_SireMaths_AccumulatorPtr__exposer.def(
"transpose"
, transpose_function_value );
}
Array2D_SireMaths_AccumulatorPtr__exposer.def( "__copy__", &__copy__);
Array2D_SireMaths_AccumulatorPtr__exposer.def( "__deepcopy__", &__copy__);
Array2D_SireMaths_AccumulatorPtr__exposer.def( "clone", &__copy__);
Array2D_SireMaths_AccumulatorPtr__exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireBase::Array2D<SireBase::PropPtr<SireMaths::Accumulator> > >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Array2D_SireMaths_AccumulatorPtr__exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireBase::Array2D<SireBase::PropPtr<SireMaths::Accumulator> > >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Array2D_SireMaths_AccumulatorPtr__exposer.def( "__str__", &__str__< ::SireBase::Array2D<SireBase::PropPtr<SireMaths::Accumulator> > > );
Array2D_SireMaths_AccumulatorPtr__exposer.def( "__repr__", &__str__< ::SireBase::Array2D<SireBase::PropPtr<SireMaths::Accumulator> > > );
}
}
void register_AtomCoords_class(){
{ //::SireMol::AtomProperty< SireMaths::Vector >
typedef bp::class_< SireMol::AtomProperty< SireMaths::Vector >, bp::bases< SireMol::AtomProp, SireMol::MolViewProperty, SireBase::Property > > AtomCoords_exposer_t;
AtomCoords_exposer_t AtomCoords_exposer = AtomCoords_exposer_t( "AtomCoords", bp::init< >() );
bp::scope AtomCoords_scope( AtomCoords_exposer );
AtomCoords_exposer.def( bp::init< SireMol::MoleculeInfoData const & >(( bp::arg("molinfo") )) );
AtomCoords_exposer.def( bp::init< SireVol::CoordGroup const & >(( bp::arg("cgroup") )) );
AtomCoords_exposer.def( bp::init< SireVol::CoordGroupArray const & >(( bp::arg("cgroups") )) );
AtomCoords_exposer.def( bp::init< SireMol::AtomProperty< SireMaths::Vector > const & >(( bp::arg("other") )) );
{ //::SireMol::AtomProperty< SireMaths::Vector >::array
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireVol::CoordGroupArray const & ( ::SireMol::AtomProperty< SireMaths::Vector >::*array_function_type )( ) const;
array_function_type array_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::array );
AtomCoords_exposer.def(
"array"
, array_function_value
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::assertCanConvert
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*assertCanConvert_function_type )( ::QVariant const & ) const;
assertCanConvert_function_type assertCanConvert_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::assertCanConvert );
AtomCoords_exposer.def(
"assertCanConvert"
, assertCanConvert_function_value
, ( bp::arg("value") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::assignFrom
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*assignFrom_function_type )( ::SireMol::AtomProperty< QVariant > const & ) ;
assignFrom_function_type assignFrom_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::assignFrom );
AtomCoords_exposer.def(
"assignFrom"
, assignFrom_function_value
, ( bp::arg("values") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::at
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireVol::CoordGroup const & ( ::SireMol::AtomProperty< SireMaths::Vector >::*at_function_type )( ::SireMol::CGIdx ) const;
at_function_type at_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::at );
AtomCoords_exposer.def(
"at"
, at_function_value
, ( bp::arg("cgidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::at
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMaths::Vector const & ( ::SireMol::AtomProperty< SireMaths::Vector >::*at_function_type )( ::SireMol::CGAtomIdx const & ) const;
at_function_type at_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::at );
AtomCoords_exposer.def(
"at"
, at_function_value
, ( bp::arg("cgatomidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::canConvert
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef bool ( ::SireMol::AtomProperty< SireMaths::Vector >::*canConvert_function_type )( ::QVariant const & ) const;
canConvert_function_type canConvert_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::canConvert );
AtomCoords_exposer.def(
"canConvert"
, canConvert_function_value
, ( bp::arg("value") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::changeFrame
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*changeFrame_function_type )( ::SireMaths::AxisSet const &,::SireMaths::AxisSet const & ) ;
changeFrame_function_type changeFrame_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::changeFrame );
AtomCoords_exposer.def(
"changeFrame"
, changeFrame_function_value
, ( bp::arg("from_frame"), bp::arg("to_frame") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::changeFrame
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*changeFrame_function_type )( ::SireMol::CGIdx,::SireMaths::AxisSet const &,::SireMaths::AxisSet const & ) ;
changeFrame_function_type changeFrame_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::changeFrame );
AtomCoords_exposer.def(
"changeFrame"
, changeFrame_function_value
, ( bp::arg("cgidx"), bp::arg("from_frame"), bp::arg("to_frame") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::copyFrom
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*copyFrom_function_type )( ::QVector< SireMaths::Vector > const & ) ;
copyFrom_function_type copyFrom_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::copyFrom );
AtomCoords_exposer.def(
"copyFrom"
, copyFrom_function_value
, ( bp::arg("values") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::copyFrom
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*copyFrom_function_type )( ::QVector< SireMaths::Vector > const &,::SireMol::AtomSelection const & ) ;
copyFrom_function_type copyFrom_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::copyFrom );
AtomCoords_exposer.def(
"copyFrom"
, copyFrom_function_value
, ( bp::arg("values"), bp::arg("selection") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::count
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef int ( ::SireMol::AtomProperty< SireMaths::Vector >::*count_function_type )( ) const;
count_function_type count_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::count );
AtomCoords_exposer.def(
"count"
, count_function_value );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::divide
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireBase::PropertyPtr ( ::SireMol::AtomProperty< SireMaths::Vector >::*divide_function_type )( ::QVector< SireMol::AtomSelection > const & ) const;
divide_function_type divide_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::divide );
AtomCoords_exposer.def(
"divide"
, divide_function_value
, ( bp::arg("beads") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::divideByResidue
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireBase::PropertyPtr ( ::SireMol::AtomProperty< SireMaths::Vector >::*divideByResidue_function_type )( ::SireMol::MoleculeInfoData const & ) const;
divideByResidue_function_type divideByResidue_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::divideByResidue );
AtomCoords_exposer.def(
"divideByResidue"
, divideByResidue_function_value
, ( bp::arg("molinfo") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::fromVariant
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMol::AtomProperty< SireMaths::Vector > ( *fromVariant_function_type )( ::SireMol::AtomProperty< QVariant > const & );
fromVariant_function_type fromVariant_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::fromVariant );
AtomCoords_exposer.def(
"fromVariant"
, fromVariant_function_value
, ( bp::arg("variant") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::get
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireVol::CoordGroup const & ( ::SireMol::AtomProperty< SireMaths::Vector >::*get_function_type )( ::SireMol::CGIdx ) const;
get_function_type get_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::get );
AtomCoords_exposer.def(
"get"
, get_function_value
, ( bp::arg("cgidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::get
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMaths::Vector const & ( ::SireMol::AtomProperty< SireMaths::Vector >::*get_function_type )( ::SireMol::CGAtomIdx const & ) const;
get_function_type get_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::get );
AtomCoords_exposer.def(
"get"
, get_function_value
, ( bp::arg("cgatomidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::isCompatibleWith
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef bool ( ::SireMol::AtomProperty< SireMaths::Vector >::*isCompatibleWith_function_type )( ::SireMol::MoleculeInfoData const & ) const;
isCompatibleWith_function_type isCompatibleWith_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::isCompatibleWith );
AtomCoords_exposer.def(
"isCompatibleWith"
, isCompatibleWith_function_value
, ( bp::arg("molinfo") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::mapInto
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*mapInto_function_type )( ::SireMaths::AxisSet const & ) ;
mapInto_function_type mapInto_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::mapInto );
AtomCoords_exposer.def(
"mapInto"
, mapInto_function_value
, ( bp::arg("axes") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::mapInto
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*mapInto_function_type )( ::SireMol::CGIdx,::SireMaths::AxisSet const & ) ;
mapInto_function_type mapInto_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::mapInto );
AtomCoords_exposer.def(
"mapInto"
, mapInto_function_value
, ( bp::arg("cgidx"), bp::arg("axes") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::merge
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireBase::PropertyPtr ( ::SireMol::AtomProperty< SireMaths::Vector >::*merge_function_type )( ::SireMol::MoleculeInfoData const & ) const;
merge_function_type merge_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::merge );
AtomCoords_exposer.def(
"merge"
, merge_function_value
, ( bp::arg("molinfo") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::nAtoms
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef int ( ::SireMol::AtomProperty< SireMaths::Vector >::*nAtoms_function_type )( ) const;
nAtoms_function_type nAtoms_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::nAtoms );
AtomCoords_exposer.def(
"nAtoms"
, nAtoms_function_value );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::nAtoms
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef int ( ::SireMol::AtomProperty< SireMaths::Vector >::*nAtoms_function_type )( ::SireMol::CGIdx ) const;
nAtoms_function_type nAtoms_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::nAtoms );
AtomCoords_exposer.def(
"nAtoms"
, nAtoms_function_value
, ( bp::arg("cgidx") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::nCutGroups
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef int ( ::SireMol::AtomProperty< SireMaths::Vector >::*nCutGroups_function_type )( ) const;
nCutGroups_function_type nCutGroups_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::nCutGroups );
AtomCoords_exposer.def(
"nCutGroups"
, nCutGroups_function_value );
}
AtomCoords_exposer.def( bp::self != bp::self );
{ //::SireMol::AtomProperty< SireMaths::Vector >::operator=
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMol::AtomProperty< SireMaths::Vector > & ( ::SireMol::AtomProperty< SireMaths::Vector >::*assign_function_type )( ::SireMol::AtomProperty< SireMaths::Vector > const & ) ;
assign_function_type assign_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::operator= );
AtomCoords_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
AtomCoords_exposer.def( bp::self == bp::self );
{ //::SireMol::AtomProperty< SireMaths::Vector >::operator[]
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireVol::CoordGroup const & ( ::SireMol::AtomProperty< SireMaths::Vector >::*__getitem___function_type )( ::SireMol::CGIdx ) const;
__getitem___function_type __getitem___function_value( &::SireMol::AtomProperty< SireMaths::Vector >::operator[] );
AtomCoords_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("cgidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::operator[]
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMaths::Vector const & ( ::SireMol::AtomProperty< SireMaths::Vector >::*__getitem___function_type )( ::SireMol::CGAtomIdx const & ) const;
__getitem___function_type __getitem___function_value( &::SireMol::AtomProperty< SireMaths::Vector >::operator[] );
AtomCoords_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("cgatomidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::rotate
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*rotate_function_type )( ::SireMaths::Quaternion const &,::SireMaths::Vector const & ) ;
rotate_function_type rotate_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::rotate );
AtomCoords_exposer.def(
"rotate"
, rotate_function_value
, ( bp::arg("quat"), bp::arg("point") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::rotate
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*rotate_function_type )( ::SireMaths::Matrix const &,::SireMaths::Vector const & ) ;
rotate_function_type rotate_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::rotate );
AtomCoords_exposer.def(
"rotate"
, rotate_function_value
, ( bp::arg("rotmat"), bp::arg("point") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::rotate
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*rotate_function_type )( ::SireMol::CGIdx,::SireMaths::Quaternion const &,::SireMaths::Vector const & ) ;
rotate_function_type rotate_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::rotate );
AtomCoords_exposer.def(
"rotate"
, rotate_function_value
, ( bp::arg("cgidx"), bp::arg("quat"), bp::arg("point") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::rotate
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*rotate_function_type )( ::SireMol::CGIdx,::SireMaths::Matrix const &,::SireMaths::Vector const & ) ;
rotate_function_type rotate_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::rotate );
AtomCoords_exposer.def(
"rotate"
, rotate_function_value
, ( bp::arg("cgidx"), bp::arg("rotmat"), bp::arg("point") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::set
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMol::AtomProperty< SireMaths::Vector > & ( ::SireMol::AtomProperty< SireMaths::Vector >::*set_function_type )( ::SireMol::CGAtomIdx const &,::SireMaths::Vector const & ) ;
set_function_type set_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::set );
AtomCoords_exposer.def(
"set"
, set_function_value
, ( bp::arg("cgatomidx"), bp::arg("value") )
, bp::return_self< >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::set
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMol::AtomProperty< SireMaths::Vector > & ( ::SireMol::AtomProperty< SireMaths::Vector >::*set_function_type )( ::SireMol::CGIdx,::QVector< SireMaths::Vector > const & ) ;
set_function_type set_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::set );
AtomCoords_exposer.def(
"set"
, set_function_value
, ( bp::arg("cgidx"), bp::arg("values") )
, bp::return_self< >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::set
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMol::AtomProperty< SireMaths::Vector > & ( ::SireMol::AtomProperty< SireMaths::Vector >::*set_function_type )( ::SireMol::CGIdx,::SireVol::CoordGroup const & ) ;
set_function_type set_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::set );
AtomCoords_exposer.def(
"set"
, set_function_value
, ( bp::arg("cgidx"), bp::arg("cgroup") )
, bp::return_self< >() );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::size
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef int ( ::SireMol::AtomProperty< SireMaths::Vector >::*size_function_type )( ) const;
size_function_type size_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::size );
AtomCoords_exposer.def(
"size"
, size_function_value );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::toVariant
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::SireMol::AtomProperty< QVariant > ( ::SireMol::AtomProperty< SireMaths::Vector >::*toVariant_function_type )( ) const;
toVariant_function_type toVariant_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::toVariant );
AtomCoords_exposer.def(
"toVariant"
, toVariant_function_value );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::toVector
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::QVector< SireMaths::Vector > ( ::SireMol::AtomProperty< SireMaths::Vector >::*toVector_function_type )( ) const;
toVector_function_type toVector_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::toVector );
AtomCoords_exposer.def(
"toVector"
, toVector_function_value );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::toVector
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef ::QVector< SireMaths::Vector > ( ::SireMol::AtomProperty< SireMaths::Vector >::*toVector_function_type )( ::SireMol::AtomSelection const & ) const;
toVector_function_type toVector_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::toVector );
AtomCoords_exposer.def(
"toVector"
, toVector_function_value
, ( bp::arg("selection") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::transform
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*transform_function_type )( ::SireMaths::Transform const & ) ;
transform_function_type transform_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::transform );
AtomCoords_exposer.def(
"transform"
, transform_function_value
, ( bp::arg("t") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::transform
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*transform_function_type )( ::SireMol::CGIdx,::SireMaths::Transform const & ) ;
transform_function_type transform_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::transform );
AtomCoords_exposer.def(
"transform"
, transform_function_value
, ( bp::arg("cgidx"), bp::arg("t") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::translate
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*translate_function_type )( ::SireMaths::Vector const & ) ;
translate_function_type translate_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::translate );
AtomCoords_exposer.def(
"translate"
, translate_function_value
, ( bp::arg("delta") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::translate
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef void ( ::SireMol::AtomProperty< SireMaths::Vector >::*translate_function_type )( ::SireMol::CGIdx,::SireMaths::Vector const & ) ;
translate_function_type translate_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::translate );
AtomCoords_exposer.def(
"translate"
, translate_function_value
, ( bp::arg("cgidx"), bp::arg("delta") ) );
}
{ //::SireMol::AtomProperty< SireMaths::Vector >::typeName
typedef SireMol::AtomProperty< SireMaths::Vector > exported_class_t;
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMol::AtomProperty< SireMaths::Vector >::typeName );
AtomCoords_exposer.def(
"typeName"
, typeName_function_value );
}
AtomCoords_exposer.staticmethod( "fromVariant" );
AtomCoords_exposer.staticmethod( "typeName" );
AtomCoords_exposer.def( "__copy__", &__copy__);
AtomCoords_exposer.def( "__deepcopy__", &__copy__);
AtomCoords_exposer.def( "clone", &__copy__);
AtomCoords_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMol::AtomProperty<SireMaths::Vector> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
AtomCoords_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMol::AtomProperty<SireMaths::Vector> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
AtomCoords_exposer.def( "__str__", &__str__< ::SireMol::AtomProperty<SireMaths::Vector> > );
AtomCoords_exposer.def( "__repr__", &__str__< ::SireMol::AtomProperty<SireMaths::Vector> > );
AtomCoords_exposer.def( "__len__", &__len_size< ::SireMol::AtomProperty<SireMaths::Vector> > );
}
}
void register_Torsion_class(){
{ //::SireMaths::Torsion
typedef bp::class_< SireMaths::Torsion > Torsion_exposer_t;
Torsion_exposer_t Torsion_exposer = Torsion_exposer_t( "Torsion", "\nThis class represents a torsion in three dimensional space, e.g. four points\nin space, not necessarily lying in a plane. A torsion is used to calculate\ndihedral angles (imagine each point is an atom). I am not happy with the\nname of this class, and welcome suggestions :-)\n\nAuthor: Christopher Woods\n", bp::init< >("Construct a zero torsion") );
bp::scope Torsion_scope( Torsion_exposer );
Torsion_exposer.def( bp::init< SireMaths::Vector const &, SireMaths::Vector const &, SireMaths::Vector const &, SireMaths::Vector const & >(( bp::arg("point0"), bp::arg("point1"), bp::arg("point2"), bp::arg("point3") ), "Construct a torsion from the points 0 to 4") );
{ //::SireMaths::Torsion::angle
typedef ::SireUnits::Dimension::Angle ( ::SireMaths::Torsion::*angle_function_type)( ) const;
angle_function_type angle_function_value( &::SireMaths::Torsion::angle );
Torsion_exposer.def(
"angle"
, angle_function_value
, "Return the torsion angle of this torsion (the torsion angle 0-1-2-3\naround the 1-2 line)" );
}
{ //::SireMaths::Torsion::at
typedef ::SireMaths::Vector const & ( ::SireMaths::Torsion::*at_function_type)( int ) const;
at_function_type at_function_value( &::SireMaths::Torsion::at );
Torsion_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "Return the point at index i" );
}
{ //::SireMaths::Torsion::count
typedef int ( ::SireMaths::Torsion::*count_function_type)( ) const;
count_function_type count_function_value( &::SireMaths::Torsion::count );
Torsion_exposer.def(
"count"
, count_function_value
, "Return the number of points in a torsion (4)" );
}
{ //::SireMaths::Torsion::improperAngle
typedef ::SireUnits::Dimension::Angle ( ::SireMaths::Torsion::*improperAngle_function_type)( ) const;
improperAngle_function_type improperAngle_function_value( &::SireMaths::Torsion::improperAngle );
Torsion_exposer.def(
"improperAngle"
, improperAngle_function_value
, "Return the improper angle of this torsion (the acute angle between the\nvector 0-1 and the plane formed by 1-2-3)" );
}
{ //::SireMaths::Torsion::line03
typedef ::SireMaths::Line ( ::SireMaths::Torsion::*line03_function_type)( ) const;
line03_function_type line03_function_value( &::SireMaths::Torsion::line03 );
Torsion_exposer.def(
"line03"
, line03_function_value
, "Return the line from point 0 to point 3" );
}
{ //::SireMaths::Torsion::line12
typedef ::SireMaths::Line ( ::SireMaths::Torsion::*line12_function_type)( ) const;
line12_function_type line12_function_value( &::SireMaths::Torsion::line12 );
Torsion_exposer.def(
"line12"
, line12_function_value
, "Return the line from point 1 to point 2" );
}
{ //::SireMaths::Torsion::operator[]
typedef ::SireMaths::Vector const & ( ::SireMaths::Torsion::*__getitem___function_type)( int ) const;
__getitem___function_type __getitem___function_value( &::SireMaths::Torsion::operator[] );
Torsion_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMaths::Torsion::point
typedef ::SireMaths::Vector const & ( ::SireMaths::Torsion::*point_function_type)( int ) const;
point_function_type point_function_value( &::SireMaths::Torsion::point );
Torsion_exposer.def(
"point"
, point_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "Return the point at index i" );
}
{ //::SireMaths::Torsion::toString
typedef ::QString ( ::SireMaths::Torsion::*toString_function_type)( ) const;
toString_function_type toString_function_value( &::SireMaths::Torsion::toString );
Torsion_exposer.def(
"toString"
, toString_function_value
, "Return a string representation of this torsion" );
}
{ //::SireMaths::Torsion::triangle1
typedef ::SireMaths::Triangle ( ::SireMaths::Torsion::*triangle1_function_type)( ) const;
triangle1_function_type triangle1_function_value( &::SireMaths::Torsion::triangle1 );
Torsion_exposer.def(
"triangle1"
, triangle1_function_value
, "Return the triangle around point 1, i.e. point0-point1-point2" );
}
{ //::SireMaths::Torsion::triangle2
typedef ::SireMaths::Triangle ( ::SireMaths::Torsion::*triangle2_function_type)( ) const;
triangle2_function_type triangle2_function_value( &::SireMaths::Torsion::triangle2 );
Torsion_exposer.def(
"triangle2"
, triangle2_function_value
, "Return the triangle around point 2, i.e. point1-point2-point3" );
}
{ //::SireMaths::Torsion::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMaths::Torsion::typeName );
Torsion_exposer.def(
"typeName"
, typeName_function_value
, "" );
}
{ //::SireMaths::Torsion::vector03
typedef ::SireMaths::Vector ( ::SireMaths::Torsion::*vector03_function_type)( ) const;
vector03_function_type vector03_function_value( &::SireMaths::Torsion::vector03 );
Torsion_exposer.def(
"vector03"
, vector03_function_value
, "Return the vector from point 0 to point 3" );
}
{ //::SireMaths::Torsion::vector12
typedef ::SireMaths::Vector ( ::SireMaths::Torsion::*vector12_function_type)( ) const;
vector12_function_type vector12_function_value( &::SireMaths::Torsion::vector12 );
Torsion_exposer.def(
"vector12"
, vector12_function_value
, "Return the vector from point 1 to point 2" );
}
{ //::SireMaths::Torsion::what
typedef char const * ( ::SireMaths::Torsion::*what_function_type)( ) const;
what_function_type what_function_value( &::SireMaths::Torsion::what );
Torsion_exposer.def(
"what"
, what_function_value
, "" );
}
Torsion_exposer.staticmethod( "typeName" );
Torsion_exposer.def( "__copy__", &__copy__);
Torsion_exposer.def( "__deepcopy__", &__copy__);
Torsion_exposer.def( "clone", &__copy__);
Torsion_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMaths::Torsion >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Torsion_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMaths::Torsion >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Torsion_exposer.def( "__str__", &__str__< ::SireMaths::Torsion > );
Torsion_exposer.def( "__repr__", &__str__< ::SireMaths::Torsion > );
Torsion_exposer.def( "__len__", &__len_count< ::SireMaths::Torsion > );
}
}
void register_PackedArray2D_int_Array_class(){
{ //::SireBase::detail::PackedArray2D_Array< int >
typedef bp::class_< SireBase::detail::PackedArray2D_Array< int > > PackedArray2D_int_Array_exposer_t;
PackedArray2D_int_Array_exposer_t PackedArray2D_int_Array_exposer = PackedArray2D_int_Array_exposer_t( "PackedArray2D_int_Array", bp::init< >() );
bp::scope PackedArray2D_int_Array_scope( PackedArray2D_int_Array_exposer );
PackedArray2D_int_Array_exposer.def( bp::init< quint32 >(( bp::arg("sz") )) );
PackedArray2D_int_Array_exposer.def( bp::init< quint32, int const & >(( bp::arg("sz"), bp::arg("value") )) );
PackedArray2D_int_Array_exposer.def( bp::init< QVector< int > const & >(( bp::arg("values") )) );
PackedArray2D_int_Array_exposer.def( bp::init< SireBase::detail::PackedArray2D_Array< int > const & >(( bp::arg("other") )) );
{ //::SireBase::detail::PackedArray2D_Array< int >::assertValidIndex
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef void ( ::SireBase::detail::PackedArray2D_Array< int >::*assertValidIndex_function_type )( ::quint32 ) const;
assertValidIndex_function_type assertValidIndex_function_value( &::SireBase::detail::PackedArray2D_Array< int >::assertValidIndex );
PackedArray2D_int_Array_exposer.def(
"assertValidIndex"
, assertValidIndex_function_value
, ( bp::arg("i") ) );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::at
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef int const & ( ::SireBase::detail::PackedArray2D_Array< int >::*at_function_type )( ::quint32 ) const;
at_function_type at_function_value( &::SireBase::detail::PackedArray2D_Array< int >::at );
PackedArray2D_int_Array_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::count
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef int ( ::SireBase::detail::PackedArray2D_Array< int >::*count_function_type )( ) const;
count_function_type count_function_value( &::SireBase::detail::PackedArray2D_Array< int >::count );
PackedArray2D_int_Array_exposer.def(
"count"
, count_function_value );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::isEmpty
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef bool ( ::SireBase::detail::PackedArray2D_Array< int >::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireBase::detail::PackedArray2D_Array< int >::isEmpty );
PackedArray2D_int_Array_exposer.def(
"isEmpty"
, isEmpty_function_value );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::nValues
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef int ( ::SireBase::detail::PackedArray2D_Array< int >::*nValues_function_type )( ) const;
nValues_function_type nValues_function_value( &::SireBase::detail::PackedArray2D_Array< int >::nValues );
PackedArray2D_int_Array_exposer.def(
"nValues"
, nValues_function_value );
}
PackedArray2D_int_Array_exposer.def( bp::self != bp::self );
{ //::SireBase::detail::PackedArray2D_Array< int >::operator=
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef ::SireBase::detail::PackedArray2D_Array< int > & ( ::SireBase::detail::PackedArray2D_Array< int >::*assign_function_type )( ::SireBase::detail::PackedArray2D_Array< int > const & ) ;
assign_function_type assign_function_value( &::SireBase::detail::PackedArray2D_Array< int >::operator= );
PackedArray2D_int_Array_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
PackedArray2D_int_Array_exposer.def( bp::self == bp::self );
{ //::SireBase::detail::PackedArray2D_Array< int >::operator[]
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef int const & ( ::SireBase::detail::PackedArray2D_Array< int >::*__getitem___function_type )( ::quint32 ) const;
__getitem___function_type __getitem___function_value( &::SireBase::detail::PackedArray2D_Array< int >::operator[] );
PackedArray2D_int_Array_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::operator[]
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef int & ( ::SireBase::detail::PackedArray2D_Array< int >::*__getitem___function_type )( ::quint32 ) ;
__getitem___function_type __getitem___function_value( &::SireBase::detail::PackedArray2D_Array< int >::operator[] );
PackedArray2D_int_Array_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_non_const_reference >() );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::size
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef int ( ::SireBase::detail::PackedArray2D_Array< int >::*size_function_type )( ) const;
size_function_type size_function_value( &::SireBase::detail::PackedArray2D_Array< int >::size );
PackedArray2D_int_Array_exposer.def(
"size"
, size_function_value );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::toQVector
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef ::QVector< int > ( ::SireBase::detail::PackedArray2D_Array< int >::*toQVector_function_type )( ) const;
toQVector_function_type toQVector_function_value( &::SireBase::detail::PackedArray2D_Array< int >::toQVector );
PackedArray2D_int_Array_exposer.def(
"toQVector"
, toQVector_function_value );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::toString
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef ::QString ( ::SireBase::detail::PackedArray2D_Array< int >::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireBase::detail::PackedArray2D_Array< int >::toString );
PackedArray2D_int_Array_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireBase::detail::PackedArray2D_Array< int >::update
typedef SireBase::detail::PackedArray2D_Array< int > exported_class_t;
typedef void ( ::SireBase::detail::PackedArray2D_Array< int >::*update_function_type )( ::SireBase::detail::PackedArray2D_Array< int > const & ) ;
update_function_type update_function_value( &::SireBase::detail::PackedArray2D_Array< int >::update );
PackedArray2D_int_Array_exposer.def(
"update"
, update_function_value
, ( bp::arg("other") ) );
}
PackedArray2D_int_Array_exposer.def( "__copy__", &__copy__);
PackedArray2D_int_Array_exposer.def( "__deepcopy__", &__copy__);
PackedArray2D_int_Array_exposer.def( "clone", &__copy__);
PackedArray2D_int_Array_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireBase::detail::PackedArray2D_Array<int> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
PackedArray2D_int_Array_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireBase::detail::PackedArray2D_Array<int> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
PackedArray2D_int_Array_exposer.def( "__str__", &__str__< ::SireBase::detail::PackedArray2D_Array<int> > );
PackedArray2D_int_Array_exposer.def( "__repr__", &__str__< ::SireBase::detail::PackedArray2D_Array<int> > );
PackedArray2D_int_Array_exposer.def( "__len__", &__len_size< ::SireBase::detail::PackedArray2D_Array<int> > );
}
}
void register_G1FF_class(){
{ //::SireFF::G1FF
typedef bp::class_< SireFF::G1FF, bp::bases< SireFF::FF, SireMol::MolGroupsBase, SireBase::Property >, boost::noncopyable > G1FF_exposer_t;
G1FF_exposer_t G1FF_exposer = G1FF_exposer_t( "G1FF", bp::no_init );
bp::scope G1FF_scope( G1FF_exposer );
{ //::SireFF::G1FF::accept
typedef void ( ::SireFF::G1FF::*accept_function_type )( ) ;
accept_function_type accept_function_value( &::SireFF::G1FF::accept );
G1FF_exposer.def(
"accept"
, accept_function_value );
}
{ //::SireFF::G1FF::add
typedef void ( ::SireFF::G1FF::*add_function_type )( ::SireMol::MoleculeView const &,::SireBase::PropertyMap const & ) ;
add_function_type add_function_value( &::SireFF::G1FF::add );
G1FF_exposer.def(
"add"
, add_function_value
, ( bp::arg("molview"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::add
typedef void ( ::SireFF::G1FF::*add_function_type )( ::SireMol::ViewsOfMol const &,::SireBase::PropertyMap const & ) ;
add_function_type add_function_value( &::SireFF::G1FF::add );
G1FF_exposer.def(
"add"
, add_function_value
, ( bp::arg("molviews"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::add
typedef void ( ::SireFF::G1FF::*add_function_type )( ::SireMol::Molecules const &,::SireBase::PropertyMap const & ) ;
add_function_type add_function_value( &::SireFF::G1FF::add );
G1FF_exposer.def(
"add"
, add_function_value
, ( bp::arg("molecules"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::add
typedef void ( ::SireFF::G1FF::*add_function_type )( ::SireMol::MoleculeGroup const &,::SireBase::PropertyMap const & ) ;
add_function_type add_function_value( &::SireFF::G1FF::add );
G1FF_exposer.def(
"add"
, add_function_value
, ( bp::arg("molgroup"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::add
typedef void ( ::SireFF::G1FF::*add_function_type )( ::SireMol::MoleculeView const & ) ;
add_function_type add_function_value( &::SireFF::G1FF::add );
G1FF_exposer.def(
"add"
, add_function_value
, ( bp::arg("molview") ) );
}
{ //::SireFF::G1FF::add
typedef void ( ::SireFF::G1FF::*add_function_type )( ::SireMol::ViewsOfMol const & ) ;
add_function_type add_function_value( &::SireFF::G1FF::add );
G1FF_exposer.def(
"add"
, add_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireFF::G1FF::add
typedef void ( ::SireFF::G1FF::*add_function_type )( ::SireMol::Molecules const & ) ;
add_function_type add_function_value( &::SireFF::G1FF::add );
G1FF_exposer.def(
"add"
, add_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireFF::G1FF::add
typedef void ( ::SireFF::G1FF::*add_function_type )( ::SireMol::MoleculeGroup const & ) ;
add_function_type add_function_value( &::SireFF::G1FF::add );
G1FF_exposer.def(
"add"
, add_function_value
, ( bp::arg("molgroup") ) );
}
{ //::SireFF::G1FF::addIfUnique
typedef void ( ::SireFF::G1FF::*addIfUnique_function_type )( ::SireMol::MoleculeView const &,::SireBase::PropertyMap const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireFF::G1FF::addIfUnique );
G1FF_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molview"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::addIfUnique
typedef void ( ::SireFF::G1FF::*addIfUnique_function_type )( ::SireMol::ViewsOfMol const &,::SireBase::PropertyMap const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireFF::G1FF::addIfUnique );
G1FF_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molviews"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::addIfUnique
typedef void ( ::SireFF::G1FF::*addIfUnique_function_type )( ::SireMol::Molecules const &,::SireBase::PropertyMap const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireFF::G1FF::addIfUnique );
G1FF_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molecules"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::addIfUnique
typedef void ( ::SireFF::G1FF::*addIfUnique_function_type )( ::SireMol::MoleculeGroup const &,::SireBase::PropertyMap const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireFF::G1FF::addIfUnique );
G1FF_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molgroup"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::addIfUnique
typedef void ( ::SireFF::G1FF::*addIfUnique_function_type )( ::SireMol::MoleculeView const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireFF::G1FF::addIfUnique );
G1FF_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molview") ) );
}
{ //::SireFF::G1FF::addIfUnique
typedef void ( ::SireFF::G1FF::*addIfUnique_function_type )( ::SireMol::ViewsOfMol const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireFF::G1FF::addIfUnique );
G1FF_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireFF::G1FF::addIfUnique
typedef void ( ::SireFF::G1FF::*addIfUnique_function_type )( ::SireMol::Molecules const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireFF::G1FF::addIfUnique );
G1FF_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireFF::G1FF::addIfUnique
typedef void ( ::SireFF::G1FF::*addIfUnique_function_type )( ::SireMol::MoleculeGroup const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireFF::G1FF::addIfUnique );
G1FF_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molgroup") ) );
}
{ //::SireFF::G1FF::assertContains
typedef void ( ::SireFF::G1FF::*assertContains_function_type )( ::SireMol::MGNum ) const;
assertContains_function_type assertContains_function_value( &::SireFF::G1FF::assertContains );
G1FF_exposer.def(
"assertContains"
, assertContains_function_value
, ( bp::arg("mgnum") ) );
}
{ //::SireFF::G1FF::at
typedef ::SireMol::MoleculeGroup const & ( ::SireFF::G1FF::*at_function_type )( ::SireMol::MGNum ) const;
at_function_type at_function_value( &::SireFF::G1FF::at );
G1FF_exposer.def(
"at"
, at_function_value
, ( bp::arg("mgnum") )
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireFF::G1FF::needsAccepting
typedef bool ( ::SireFF::G1FF::*needsAccepting_function_type )( ) const;
needsAccepting_function_type needsAccepting_function_value( &::SireFF::G1FF::needsAccepting );
G1FF_exposer.def(
"needsAccepting"
, needsAccepting_function_value );
}
{ //::SireFF::G1FF::remove
typedef bool ( ::SireFF::G1FF::*remove_function_type )( ::SireMol::MoleculeView const & ) ;
remove_function_type remove_function_value( &::SireFF::G1FF::remove );
G1FF_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molview") ) );
}
{ //::SireFF::G1FF::remove
typedef bool ( ::SireFF::G1FF::*remove_function_type )( ::SireMol::ViewsOfMol const & ) ;
remove_function_type remove_function_value( &::SireFF::G1FF::remove );
G1FF_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireFF::G1FF::remove
typedef bool ( ::SireFF::G1FF::*remove_function_type )( ::SireMol::Molecules const & ) ;
remove_function_type remove_function_value( &::SireFF::G1FF::remove );
G1FF_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireFF::G1FF::remove
typedef bool ( ::SireFF::G1FF::*remove_function_type )( ::SireMol::MoleculeGroup const & ) ;
remove_function_type remove_function_value( &::SireFF::G1FF::remove );
G1FF_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molgroup") ) );
}
{ //::SireFF::G1FF::remove
typedef bool ( ::SireFF::G1FF::*remove_function_type )( ::SireMol::MolNum ) ;
remove_function_type remove_function_value( &::SireFF::G1FF::remove );
G1FF_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molnum") ) );
}
{ //::SireFF::G1FF::remove
typedef bool ( ::SireFF::G1FF::*remove_function_type )( ::QSet< SireMol::MolNum > const & ) ;
remove_function_type remove_function_value( &::SireFF::G1FF::remove );
G1FF_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molnums") ) );
}
{ //::SireFF::G1FF::removeAll
typedef bool ( ::SireFF::G1FF::*removeAll_function_type )( ) ;
removeAll_function_type removeAll_function_value( &::SireFF::G1FF::removeAll );
G1FF_exposer.def(
"removeAll"
, removeAll_function_value );
}
{ //::SireFF::G1FF::removeAll
typedef bool ( ::SireFF::G1FF::*removeAll_function_type )( ::SireMol::MoleculeView const & ) ;
removeAll_function_type removeAll_function_value( &::SireFF::G1FF::removeAll );
G1FF_exposer.def(
"removeAll"
, removeAll_function_value
, ( bp::arg("molview") ) );
}
{ //::SireFF::G1FF::removeAll
typedef bool ( ::SireFF::G1FF::*removeAll_function_type )( ::SireMol::ViewsOfMol const & ) ;
removeAll_function_type removeAll_function_value( &::SireFF::G1FF::removeAll );
G1FF_exposer.def(
"removeAll"
, removeAll_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireFF::G1FF::removeAll
typedef bool ( ::SireFF::G1FF::*removeAll_function_type )( ::SireMol::Molecules const & ) ;
removeAll_function_type removeAll_function_value( &::SireFF::G1FF::removeAll );
G1FF_exposer.def(
"removeAll"
, removeAll_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireFF::G1FF::removeAll
typedef bool ( ::SireFF::G1FF::*removeAll_function_type )( ::SireMol::MoleculeGroup const & ) ;
removeAll_function_type removeAll_function_value( &::SireFF::G1FF::removeAll );
G1FF_exposer.def(
"removeAll"
, removeAll_function_value
, ( bp::arg("molgroup") ) );
}
{ //::SireFF::G1FF::setContents
typedef void ( ::SireFF::G1FF::*setContents_function_type )( ::SireMol::MoleculeView const & ) ;
setContents_function_type setContents_function_value( &::SireFF::G1FF::setContents );
G1FF_exposer.def(
"setContents"
, setContents_function_value
, ( bp::arg("molview") ) );
}
{ //::SireFF::G1FF::setContents
typedef void ( ::SireFF::G1FF::*setContents_function_type )( ::SireMol::ViewsOfMol const & ) ;
setContents_function_type setContents_function_value( &::SireFF::G1FF::setContents );
G1FF_exposer.def(
"setContents"
, setContents_function_value
, ( bp::arg("molview") ) );
}
{ //::SireFF::G1FF::setContents
typedef void ( ::SireFF::G1FF::*setContents_function_type )( ::SireMol::Molecules const & ) ;
setContents_function_type setContents_function_value( &::SireFF::G1FF::setContents );
G1FF_exposer.def(
"setContents"
, setContents_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireFF::G1FF::setContents
typedef void ( ::SireFF::G1FF::*setContents_function_type )( ::SireMol::MoleculeGroup const & ) ;
setContents_function_type setContents_function_value( &::SireFF::G1FF::setContents );
G1FF_exposer.def(
"setContents"
, setContents_function_value
, ( bp::arg("molgroup") ) );
}
{ //::SireFF::G1FF::setContents
typedef void ( ::SireFF::G1FF::*setContents_function_type )( ::SireMol::MoleculeView const &,::SireBase::PropertyMap const & ) ;
setContents_function_type setContents_function_value( &::SireFF::G1FF::setContents );
G1FF_exposer.def(
"setContents"
, setContents_function_value
, ( bp::arg("molview"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::setContents
typedef void ( ::SireFF::G1FF::*setContents_function_type )( ::SireMol::ViewsOfMol const &,::SireBase::PropertyMap const & ) ;
setContents_function_type setContents_function_value( &::SireFF::G1FF::setContents );
G1FF_exposer.def(
"setContents"
, setContents_function_value
, ( bp::arg("molviews"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::setContents
typedef void ( ::SireFF::G1FF::*setContents_function_type )( ::SireMol::Molecules const &,::SireBase::PropertyMap const & ) ;
setContents_function_type setContents_function_value( &::SireFF::G1FF::setContents );
G1FF_exposer.def(
"setContents"
, setContents_function_value
, ( bp::arg("molecules"), bp::arg("map") ) );
}
{ //::SireFF::G1FF::setContents
typedef void ( ::SireFF::G1FF::*setContents_function_type )( ::SireMol::MoleculeGroup const &,::SireBase::PropertyMap const & ) ;
setContents_function_type setContents_function_value( &::SireFF::G1FF::setContents );
G1FF_exposer.def(
"setContents"
, setContents_function_value
, ( bp::arg("molgroup"), bp::arg("map") ) );
}
G1FF_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireFF::G1FF >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
G1FF_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireFF::G1FF >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
G1FF_exposer.def( "__str__", &__str__< ::SireFF::G1FF > );
G1FF_exposer.def( "__repr__", &__str__< ::SireFF::G1FF > );
G1FF_exposer.def( "__len__", &__len_count< ::SireFF::G1FF > );
}
}
void register_Velocity3D_class(){
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >
typedef bp::class_< SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > > Velocity3D_exposer_t;
Velocity3D_exposer_t Velocity3D_exposer = Velocity3D_exposer_t( "Velocity3D", bp::init< >() );
bp::scope Velocity3D_scope( Velocity3D_exposer );
Velocity3D_exposer.def( bp::init< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const & >(( bp::arg("val") )) );
Velocity3D_exposer.def( bp::init< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const &, SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const &, SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const & >(( bp::arg("x"), bp::arg("y"), bp::arg("z") )) );
Velocity3D_exposer.def( bp::init< SireMaths::Vector const & >(( bp::arg("v") )) );
Velocity3D_exposer.def( bp::init< SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > const & >(( bp::arg("other") )) );
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::at
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef ::SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const & ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::at );
Velocity3D_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::count
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef int ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*count_function_type )( ) const;
count_function_type count_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::count );
Velocity3D_exposer.def(
"count"
, count_function_value );
}
Velocity3D_exposer.def( bp::self != bp::self );
Velocity3D_exposer.def( bp::self * bp::other< double >() );
Velocity3D_exposer.def( bp::self + bp::self );
Velocity3D_exposer.def( -bp::self );
Velocity3D_exposer.def( bp::self - bp::self );
Velocity3D_exposer.def( bp::self / bp::other< double >() );
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::operator=
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > & ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*assign_function_type )( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > const & ) ;
assign_function_type assign_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::operator= );
Velocity3D_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
Velocity3D_exposer.def( bp::self == bp::self );
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::operator[]
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef ::SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const & ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::operator[] );
Velocity3D_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::set
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef void ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*set_function_type )( int,::SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const & ) ;
set_function_type set_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::set );
Velocity3D_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("value") ) );
}
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::toString
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef ::QString ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::toString );
Velocity3D_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::typeName
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::typeName );
Velocity3D_exposer.def(
"typeName"
, typeName_function_value );
}
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::value
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef ::SireMaths::Vector ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*value_function_type )( ) const;
value_function_type value_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::value );
Velocity3D_exposer.def(
"value"
, value_function_value );
}
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::x
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef ::SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const & ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*x_function_type )( ) const;
x_function_type x_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::x );
Velocity3D_exposer.def(
"x"
, x_function_value
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::y
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef ::SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const & ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*y_function_type )( ) const;
y_function_type y_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::y );
Velocity3D_exposer.def(
"y"
, y_function_value
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::z
typedef SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > > exported_class_t;
typedef ::SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > const & ( ::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::*z_function_type )( ) const;
z_function_type z_function_value( &::SireMaths::Vector3D< SireUnits::Dimension::PhysUnit< 0, 1, -1, 0, 0, 0, 0 > >::z );
Velocity3D_exposer.def(
"z"
, z_function_value
, bp::return_value_policy< bp::copy_const_reference >() );
}
Velocity3D_exposer.staticmethod( "typeName" );
Velocity3D_exposer.def( "__copy__", &__copy__);
Velocity3D_exposer.def( "__deepcopy__", &__copy__);
Velocity3D_exposer.def( "clone", &__copy__);
Velocity3D_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMaths::Vector3D<SireUnits::Dimension::PhysUnit<0, 1, -1, 0, 0, 0, 0> > >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Velocity3D_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMaths::Vector3D<SireUnits::Dimension::PhysUnit<0, 1, -1, 0, 0, 0, 0> > >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Velocity3D_exposer.def( "__str__", &__str__< ::SireMaths::Vector3D<SireUnits::Dimension::PhysUnit<0, 1, -1, 0, 0, 0, 0> > > );
Velocity3D_exposer.def( "__repr__", &__str__< ::SireMaths::Vector3D<SireUnits::Dimension::PhysUnit<0, 1, -1, 0, 0, 0, 0> > > );
Velocity3D_exposer.def( "__len__", &__len_count< ::SireMaths::Vector3D<SireUnits::Dimension::PhysUnit<0, 1, -1, 0, 0, 0, 0> > > );
}
}
void register_AtomFloatProperty_class(){
{ //::SireMol::AtomProperty< double >
typedef bp::class_< SireMol::AtomProperty< double >, bp::bases< SireMol::AtomProp, SireMol::MolViewProperty, SireBase::Property > > AtomFloatProperty_exposer_t;
AtomFloatProperty_exposer_t AtomFloatProperty_exposer = AtomFloatProperty_exposer_t( "AtomFloatProperty", "", bp::init< >("") );
bp::scope AtomFloatProperty_scope( AtomFloatProperty_exposer );
AtomFloatProperty_exposer.def( bp::init< SireMol::MoleculeInfoData const & >(( bp::arg("molinfo") ), "") );
AtomFloatProperty_exposer.def( bp::init< SireMol::MoleculeInfoData const &, double const & >(( bp::arg("molinfo"), bp::arg("default_value") ), "") );
AtomFloatProperty_exposer.def( bp::init< double const & >(( bp::arg("value") ), "") );
AtomFloatProperty_exposer.def( bp::init< SireBase::PackedArray2D< double > const & >(( bp::arg("values") ), "") );
AtomFloatProperty_exposer.def( bp::init< SireMol::AtomProperty< double > const & >(( bp::arg("other") ), "") );
{ //::SireMol::AtomProperty< double >::array
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireBase::PackedArray2D< double > const & ( ::SireMol::AtomProperty< double >::*array_function_type)( ) const;
array_function_type array_function_value( &::SireMol::AtomProperty< double >::array );
AtomFloatProperty_exposer.def(
"array"
, array_function_value
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMol::AtomProperty< double >::assertCanConvert
typedef SireMol::AtomProperty< double > exported_class_t;
typedef void ( ::SireMol::AtomProperty< double >::*assertCanConvert_function_type)( ::QVariant const & ) const;
assertCanConvert_function_type assertCanConvert_function_value( &::SireMol::AtomProperty< double >::assertCanConvert );
AtomFloatProperty_exposer.def(
"assertCanConvert"
, assertCanConvert_function_value
, ( bp::arg("value") )
, "" );
}
{ //::SireMol::AtomProperty< double >::assignFrom
typedef SireMol::AtomProperty< double > exported_class_t;
typedef void ( ::SireMol::AtomProperty< double >::*assignFrom_function_type)( ::SireMol::AtomProperty< QVariant > const & ) ;
assignFrom_function_type assignFrom_function_value( &::SireMol::AtomProperty< double >::assignFrom );
AtomFloatProperty_exposer.def(
"assignFrom"
, assignFrom_function_value
, ( bp::arg("values") )
, "" );
}
{ //::SireMol::AtomProperty< double >::at
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireBase::PackedArray2D< double >::Array const & ( ::SireMol::AtomProperty< double >::*at_function_type)( ::SireMol::CGIdx ) const;
at_function_type at_function_value( &::SireMol::AtomProperty< double >::at );
AtomFloatProperty_exposer.def(
"at"
, at_function_value
, ( bp::arg("cgidx") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMol::AtomProperty< double >::at
typedef SireMol::AtomProperty< double > exported_class_t;
typedef double const & ( ::SireMol::AtomProperty< double >::*at_function_type)( ::SireMol::CGAtomIdx const & ) const;
at_function_type at_function_value( &::SireMol::AtomProperty< double >::at );
AtomFloatProperty_exposer.def(
"at"
, at_function_value
, ( bp::arg("cgatomidx") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMol::AtomProperty< double >::canConvert
typedef SireMol::AtomProperty< double > exported_class_t;
typedef bool ( ::SireMol::AtomProperty< double >::*canConvert_function_type)( ::QVariant const & ) const;
canConvert_function_type canConvert_function_value( &::SireMol::AtomProperty< double >::canConvert );
AtomFloatProperty_exposer.def(
"canConvert"
, canConvert_function_value
, ( bp::arg("value") )
, "" );
}
{ //::SireMol::AtomProperty< double >::copyFrom
typedef SireMol::AtomProperty< double > exported_class_t;
typedef void ( ::SireMol::AtomProperty< double >::*copyFrom_function_type)( ::QVector< double > const & ) ;
copyFrom_function_type copyFrom_function_value( &::SireMol::AtomProperty< double >::copyFrom );
AtomFloatProperty_exposer.def(
"copyFrom"
, copyFrom_function_value
, ( bp::arg("values") )
, "" );
}
{ //::SireMol::AtomProperty< double >::copyFrom
typedef SireMol::AtomProperty< double > exported_class_t;
typedef void ( ::SireMol::AtomProperty< double >::*copyFrom_function_type)( ::QVector< double > const &,::SireMol::AtomSelection const & ) ;
copyFrom_function_type copyFrom_function_value( &::SireMol::AtomProperty< double >::copyFrom );
AtomFloatProperty_exposer.def(
"copyFrom"
, copyFrom_function_value
, ( bp::arg("values"), bp::arg("selection") )
, "" );
}
{ //::SireMol::AtomProperty< double >::count
typedef SireMol::AtomProperty< double > exported_class_t;
typedef int ( ::SireMol::AtomProperty< double >::*count_function_type)( ) const;
count_function_type count_function_value( &::SireMol::AtomProperty< double >::count );
AtomFloatProperty_exposer.def(
"count"
, count_function_value
, "" );
}
{ //::SireMol::AtomProperty< double >::divide
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireBase::PropertyPtr ( ::SireMol::AtomProperty< double >::*divide_function_type)( ::QVector< SireMol::AtomSelection > const & ) const;
divide_function_type divide_function_value( &::SireMol::AtomProperty< double >::divide );
AtomFloatProperty_exposer.def(
"divide"
, divide_function_value
, ( bp::arg("beads") )
, "" );
}
{ //::SireMol::AtomProperty< double >::divideByResidue
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireBase::PropertyPtr ( ::SireMol::AtomProperty< double >::*divideByResidue_function_type)( ::SireMol::MoleculeInfoData const & ) const;
divideByResidue_function_type divideByResidue_function_value( &::SireMol::AtomProperty< double >::divideByResidue );
AtomFloatProperty_exposer.def(
"divideByResidue"
, divideByResidue_function_value
, ( bp::arg("molinfo") )
, "" );
}
{ //::SireMol::AtomProperty< double >::fromVariant
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireMol::AtomProperty< double > ( *fromVariant_function_type )( ::SireMol::AtomProperty< QVariant > const & );
fromVariant_function_type fromVariant_function_value( &::SireMol::AtomProperty< double >::fromVariant );
AtomFloatProperty_exposer.def(
"fromVariant"
, fromVariant_function_value
, ( bp::arg("variant") )
, "" );
}
{ //::SireMol::AtomProperty< double >::get
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireBase::PackedArray2D< double >::Array const & ( ::SireMol::AtomProperty< double >::*get_function_type)( ::SireMol::CGIdx ) const;
get_function_type get_function_value( &::SireMol::AtomProperty< double >::get );
AtomFloatProperty_exposer.def(
"get"
, get_function_value
, ( bp::arg("cgidx") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMol::AtomProperty< double >::get
typedef SireMol::AtomProperty< double > exported_class_t;
typedef double const & ( ::SireMol::AtomProperty< double >::*get_function_type)( ::SireMol::CGAtomIdx const & ) const;
get_function_type get_function_value( &::SireMol::AtomProperty< double >::get );
AtomFloatProperty_exposer.def(
"get"
, get_function_value
, ( bp::arg("cgatomidx") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMol::AtomProperty< double >::isCompatibleWith
typedef SireMol::AtomProperty< double > exported_class_t;
typedef bool ( ::SireMol::AtomProperty< double >::*isCompatibleWith_function_type)( ::SireMol::MoleculeInfoData const & ) const;
isCompatibleWith_function_type isCompatibleWith_function_value( &::SireMol::AtomProperty< double >::isCompatibleWith );
AtomFloatProperty_exposer.def(
"isCompatibleWith"
, isCompatibleWith_function_value
, ( bp::arg("molinfo") )
, "" );
}
{ //::SireMol::AtomProperty< double >::isCompatibleWith
typedef SireMol::AtomProperty< double > exported_class_t;
typedef bool ( ::SireMol::AtomProperty< double >::*isCompatibleWith_function_type)( ::SireMol::MoleculeInfo const & ) const;
isCompatibleWith_function_type isCompatibleWith_function_value( &::SireMol::AtomProperty< double >::isCompatibleWith );
AtomFloatProperty_exposer.def(
"isCompatibleWith"
, isCompatibleWith_function_value
, ( bp::arg("molinfo") )
, "" );
}
{ //::SireMol::AtomProperty< double >::isEmpty
typedef SireMol::AtomProperty< double > exported_class_t;
typedef bool ( ::SireMol::AtomProperty< double >::*isEmpty_function_type)( ) const;
isEmpty_function_type isEmpty_function_value( &::SireMol::AtomProperty< double >::isEmpty );
AtomFloatProperty_exposer.def(
"isEmpty"
, isEmpty_function_value
, "" );
}
{ //::SireMol::AtomProperty< double >::matchToSelection
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireMol::AtomProperty< double > ( ::SireMol::AtomProperty< double >::*matchToSelection_function_type)( ::SireMol::AtomSelection const & ) const;
matchToSelection_function_type matchToSelection_function_value( &::SireMol::AtomProperty< double >::matchToSelection );
AtomFloatProperty_exposer.def(
"matchToSelection"
, matchToSelection_function_value
, ( bp::arg("selection") )
, "" );
}
{ //::SireMol::AtomProperty< double >::merge
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireBase::PropertyPtr ( ::SireMol::AtomProperty< double >::*merge_function_type)( ::SireMol::MoleculeInfoData const & ) const;
merge_function_type merge_function_value( &::SireMol::AtomProperty< double >::merge );
AtomFloatProperty_exposer.def(
"merge"
, merge_function_value
, ( bp::arg("molinfo") )
, "" );
}
{ //::SireMol::AtomProperty< double >::nAtoms
typedef SireMol::AtomProperty< double > exported_class_t;
typedef int ( ::SireMol::AtomProperty< double >::*nAtoms_function_type)( ) const;
nAtoms_function_type nAtoms_function_value( &::SireMol::AtomProperty< double >::nAtoms );
AtomFloatProperty_exposer.def(
"nAtoms"
, nAtoms_function_value
, "" );
}
{ //::SireMol::AtomProperty< double >::nAtoms
typedef SireMol::AtomProperty< double > exported_class_t;
typedef int ( ::SireMol::AtomProperty< double >::*nAtoms_function_type)( ::SireMol::CGIdx ) const;
nAtoms_function_type nAtoms_function_value( &::SireMol::AtomProperty< double >::nAtoms );
AtomFloatProperty_exposer.def(
"nAtoms"
, nAtoms_function_value
, ( bp::arg("cgidx") )
, "" );
}
{ //::SireMol::AtomProperty< double >::nCutGroups
typedef SireMol::AtomProperty< double > exported_class_t;
typedef int ( ::SireMol::AtomProperty< double >::*nCutGroups_function_type)( ) const;
nCutGroups_function_type nCutGroups_function_value( &::SireMol::AtomProperty< double >::nCutGroups );
AtomFloatProperty_exposer.def(
"nCutGroups"
, nCutGroups_function_value
, "" );
}
AtomFloatProperty_exposer.def( bp::self != bp::self );
{ //::SireMol::AtomProperty< double >::operator=
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireMol::AtomProperty< double > & ( ::SireMol::AtomProperty< double >::*assign_function_type)( ::SireMol::AtomProperty< double > const & ) ;
assign_function_type assign_function_value( &::SireMol::AtomProperty< double >::operator= );
AtomFloatProperty_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >()
, "" );
}
AtomFloatProperty_exposer.def( bp::self == bp::self );
{ //::SireMol::AtomProperty< double >::operator[]
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireBase::PackedArray2D< double >::Array const & ( ::SireMol::AtomProperty< double >::*__getitem___function_type)( ::SireMol::CGIdx ) const;
__getitem___function_type __getitem___function_value( &::SireMol::AtomProperty< double >::operator[] );
AtomFloatProperty_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("cgidx") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMol::AtomProperty< double >::operator[]
typedef SireMol::AtomProperty< double > exported_class_t;
typedef double const & ( ::SireMol::AtomProperty< double >::*__getitem___function_type)( ::SireMol::CGAtomIdx const & ) const;
__getitem___function_type __getitem___function_value( &::SireMol::AtomProperty< double >::operator[] );
AtomFloatProperty_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("cgatomidx") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMol::AtomProperty< double >::set
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireMol::AtomProperty< double > & ( ::SireMol::AtomProperty< double >::*set_function_type)( ::SireMol::CGAtomIdx const &,double const & ) ;
set_function_type set_function_value( &::SireMol::AtomProperty< double >::set );
AtomFloatProperty_exposer.def(
"set"
, set_function_value
, ( bp::arg("cgatomidx"), bp::arg("value") )
, bp::return_self< >()
, "" );
}
{ //::SireMol::AtomProperty< double >::set
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireMol::AtomProperty< double > & ( ::SireMol::AtomProperty< double >::*set_function_type)( ::SireMol::CGIdx,::QVector< double > const & ) ;
set_function_type set_function_value( &::SireMol::AtomProperty< double >::set );
AtomFloatProperty_exposer.def(
"set"
, set_function_value
, ( bp::arg("cgidx"), bp::arg("values") )
, bp::return_self< >()
, "" );
}
{ //::SireMol::AtomProperty< double >::size
typedef SireMol::AtomProperty< double > exported_class_t;
typedef int ( ::SireMol::AtomProperty< double >::*size_function_type)( ) const;
size_function_type size_function_value( &::SireMol::AtomProperty< double >::size );
AtomFloatProperty_exposer.def(
"size"
, size_function_value
, "" );
}
{ //::SireMol::AtomProperty< double >::toString
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::QString ( ::SireMol::AtomProperty< double >::*toString_function_type)( ) const;
toString_function_type toString_function_value( &::SireMol::AtomProperty< double >::toString );
AtomFloatProperty_exposer.def(
"toString"
, toString_function_value
, "" );
}
{ //::SireMol::AtomProperty< double >::toVariant
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::SireMol::AtomProperty< QVariant > ( ::SireMol::AtomProperty< double >::*toVariant_function_type)( ) const;
toVariant_function_type toVariant_function_value( &::SireMol::AtomProperty< double >::toVariant );
AtomFloatProperty_exposer.def(
"toVariant"
, toVariant_function_value
, "" );
}
{ //::SireMol::AtomProperty< double >::toVector
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::QVector< double > ( ::SireMol::AtomProperty< double >::*toVector_function_type)( ) const;
toVector_function_type toVector_function_value( &::SireMol::AtomProperty< double >::toVector );
AtomFloatProperty_exposer.def(
"toVector"
, toVector_function_value
, "" );
}
{ //::SireMol::AtomProperty< double >::toVector
typedef SireMol::AtomProperty< double > exported_class_t;
typedef ::QVector< double > ( ::SireMol::AtomProperty< double >::*toVector_function_type)( ::SireMol::AtomSelection const & ) const;
toVector_function_type toVector_function_value( &::SireMol::AtomProperty< double >::toVector );
AtomFloatProperty_exposer.def(
"toVector"
, toVector_function_value
, ( bp::arg("selection") )
, "" );
}
{ //::SireMol::AtomProperty< double >::typeName
typedef SireMol::AtomProperty< double > exported_class_t;
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMol::AtomProperty< double >::typeName );
AtomFloatProperty_exposer.def(
"typeName"
, typeName_function_value
, "" );
}
AtomFloatProperty_exposer.staticmethod( "fromVariant" );
AtomFloatProperty_exposer.staticmethod( "typeName" );
AtomFloatProperty_exposer.def( "__copy__", &__copy__);
AtomFloatProperty_exposer.def( "__deepcopy__", &__copy__);
AtomFloatProperty_exposer.def( "clone", &__copy__);
AtomFloatProperty_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMol::AtomProperty<double> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
AtomFloatProperty_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMol::AtomProperty<double> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
AtomFloatProperty_exposer.def( "__str__", &__str__< ::SireMol::AtomProperty<double> > );
AtomFloatProperty_exposer.def( "__repr__", &__str__< ::SireMol::AtomProperty<double> > );
AtomFloatProperty_exposer.def( "__len__", &__len_size< ::SireMol::AtomProperty<double> > );
}
}
void register_GridInfo_class(){
{ //::SireVol::GridInfo
typedef bp::class_< SireVol::GridInfo > GridInfo_exposer_t;
GridInfo_exposer_t GridInfo_exposer = GridInfo_exposer_t( "GridInfo", bp::init< >() );
bp::scope GridInfo_scope( GridInfo_exposer );
GridInfo_exposer.def( bp::init< SireVol::AABox const &, SireUnits::Dimension::Length >(( bp::arg("dimensions"), bp::arg("spacing") )) );
GridInfo_exposer.def( bp::init< SireVol::GridInfo const & >(( bp::arg("other") )) );
{ //::SireVol::GridInfo::arrayToGridIndex
typedef ::SireVol::GridIndex ( ::SireVol::GridInfo::*arrayToGridIndex_function_type )( int ) const;
arrayToGridIndex_function_type arrayToGridIndex_function_value( &::SireVol::GridInfo::arrayToGridIndex );
GridInfo_exposer.def(
"arrayToGridIndex"
, arrayToGridIndex_function_value
, ( bp::arg("i") ) );
}
{ //::SireVol::GridInfo::at
typedef ::SireVol::GridIndex ( ::SireVol::GridInfo::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireVol::GridInfo::at );
GridInfo_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") ) );
}
{ //::SireVol::GridInfo::at
typedef int ( ::SireVol::GridInfo::*at_function_type )( ::SireVol::GridIndex const & ) const;
at_function_type at_function_value( &::SireVol::GridInfo::at );
GridInfo_exposer.def(
"at"
, at_function_value
, ( bp::arg("idx") ) );
}
{ //::SireVol::GridInfo::at
typedef int ( ::SireVol::GridInfo::*at_function_type )( int,int,int ) const;
at_function_type at_function_value( &::SireVol::GridInfo::at );
GridInfo_exposer.def(
"at"
, at_function_value
, ( bp::arg("i"), bp::arg("j"), bp::arg("k") ) );
}
{ //::SireVol::GridInfo::at
typedef int ( ::SireVol::GridInfo::*at_function_type )( ::SireMaths::Vector const & ) const;
at_function_type at_function_value( &::SireVol::GridInfo::at );
GridInfo_exposer.def(
"at"
, at_function_value
, ( bp::arg("point") ) );
}
{ //::SireVol::GridInfo::box
typedef ::SireVol::AABox ( ::SireVol::GridInfo::*box_function_type )( int ) const;
box_function_type box_function_value( &::SireVol::GridInfo::box );
GridInfo_exposer.def(
"box"
, box_function_value
, ( bp::arg("i") ) );
}
{ //::SireVol::GridInfo::box
typedef ::SireVol::AABox ( ::SireVol::GridInfo::*box_function_type )( ::SireVol::GridIndex const & ) const;
box_function_type box_function_value( &::SireVol::GridInfo::box );
GridInfo_exposer.def(
"box"
, box_function_value
, ( bp::arg("idx") ) );
}
{ //::SireVol::GridInfo::box
typedef ::SireVol::AABox ( ::SireVol::GridInfo::*box_function_type )( ::SireMaths::Vector const & ) const;
box_function_type box_function_value( &::SireVol::GridInfo::box );
GridInfo_exposer.def(
"box"
, box_function_value
, ( bp::arg("point") ) );
}
{ //::SireVol::GridInfo::closestIndexTo
typedef ::SireVol::GridIndex ( ::SireVol::GridInfo::*closestIndexTo_function_type )( ::SireMaths::Vector const & ) const;
closestIndexTo_function_type closestIndexTo_function_value( &::SireVol::GridInfo::closestIndexTo );
GridInfo_exposer.def(
"closestIndexTo"
, closestIndexTo_function_value
, ( bp::arg("point") ) );
}
{ //::SireVol::GridInfo::contains
typedef bool ( ::SireVol::GridInfo::*contains_function_type )( ::SireMaths::Vector const & ) const;
contains_function_type contains_function_value( &::SireVol::GridInfo::contains );
GridInfo_exposer.def(
"contains"
, contains_function_value
, ( bp::arg("point") ) );
}
{ //::SireVol::GridInfo::count
typedef int ( ::SireVol::GridInfo::*count_function_type )( ) const;
count_function_type count_function_value( &::SireVol::GridInfo::count );
GridInfo_exposer.def(
"count"
, count_function_value );
}
{ //::SireVol::GridInfo::dimX
typedef ::qint32 ( ::SireVol::GridInfo::*dimX_function_type )( ) const;
dimX_function_type dimX_function_value( &::SireVol::GridInfo::dimX );
GridInfo_exposer.def(
"dimX"
, dimX_function_value );
}
{ //::SireVol::GridInfo::dimY
typedef ::qint32 ( ::SireVol::GridInfo::*dimY_function_type )( ) const;
dimY_function_type dimY_function_value( &::SireVol::GridInfo::dimY );
GridInfo_exposer.def(
"dimY"
, dimY_function_value );
}
{ //::SireVol::GridInfo::dimZ
typedef ::qint32 ( ::SireVol::GridInfo::*dimZ_function_type )( ) const;
dimZ_function_type dimZ_function_value( &::SireVol::GridInfo::dimZ );
GridInfo_exposer.def(
"dimZ"
, dimZ_function_value );
}
{ //::SireVol::GridInfo::dimensions
typedef ::SireVol::AABox ( ::SireVol::GridInfo::*dimensions_function_type )( ) const;
dimensions_function_type dimensions_function_value( &::SireVol::GridInfo::dimensions );
GridInfo_exposer.def(
"dimensions"
, dimensions_function_value );
}
{ //::SireVol::GridInfo::getitem
typedef ::SireVol::GridIndex ( ::SireVol::GridInfo::*getitem_function_type )( int ) const;
getitem_function_type getitem_function_value( &::SireVol::GridInfo::getitem );
GridInfo_exposer.def(
"getitem"
, getitem_function_value
, ( bp::arg("i") ) );
}
{ //::SireVol::GridInfo::gridToArrayIndex
typedef int ( ::SireVol::GridInfo::*gridToArrayIndex_function_type )( int,int,int ) const;
gridToArrayIndex_function_type gridToArrayIndex_function_value( &::SireVol::GridInfo::gridToArrayIndex );
GridInfo_exposer.def(
"gridToArrayIndex"
, gridToArrayIndex_function_value
, ( bp::arg("i"), bp::arg("j"), bp::arg("k") ) );
}
{ //::SireVol::GridInfo::gridToArrayIndex
typedef int ( ::SireVol::GridInfo::*gridToArrayIndex_function_type )( ::SireVol::GridIndex const & ) const;
gridToArrayIndex_function_type gridToArrayIndex_function_value( &::SireVol::GridInfo::gridToArrayIndex );
GridInfo_exposer.def(
"gridToArrayIndex"
, gridToArrayIndex_function_value
, ( bp::arg("idx") ) );
}
{ //::SireVol::GridInfo::indexOf
typedef ::SireVol::GridIndex ( ::SireVol::GridInfo::*indexOf_function_type )( int,::SireVol::GridInfo const & ) const;
indexOf_function_type indexOf_function_value( &::SireVol::GridInfo::indexOf );
GridInfo_exposer.def(
"indexOf"
, indexOf_function_value
, ( bp::arg("i"), bp::arg("grid") ) );
}
{ //::SireVol::GridInfo::indexOf
typedef ::SireVol::GridIndex ( ::SireVol::GridInfo::*indexOf_function_type )( ::SireVol::GridIndex const &,::SireVol::GridInfo const & ) const;
indexOf_function_type indexOf_function_value( &::SireVol::GridInfo::indexOf );
GridInfo_exposer.def(
"indexOf"
, indexOf_function_value
, ( bp::arg("idx"), bp::arg("grid") ) );
}
{ //::SireVol::GridInfo::isEmpty
typedef bool ( ::SireVol::GridInfo::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireVol::GridInfo::isEmpty );
GridInfo_exposer.def(
"isEmpty"
, isEmpty_function_value );
}
{ //::SireVol::GridInfo::nPoints
typedef int ( ::SireVol::GridInfo::*nPoints_function_type )( ) const;
nPoints_function_type nPoints_function_value( &::SireVol::GridInfo::nPoints );
GridInfo_exposer.def(
"nPoints"
, nPoints_function_value );
}
GridInfo_exposer.def( bp::self != bp::self );
{ //::SireVol::GridInfo::operator=
typedef ::SireVol::GridInfo & ( ::SireVol::GridInfo::*assign_function_type )( ::SireVol::GridInfo const & ) ;
assign_function_type assign_function_value( &::SireVol::GridInfo::operator= );
GridInfo_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
GridInfo_exposer.def( bp::self == bp::self );
{ //::SireVol::GridInfo::operator[]
typedef ::SireVol::GridIndex ( ::SireVol::GridInfo::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireVol::GridInfo::operator[] );
GridInfo_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") ) );
}
{ //::SireVol::GridInfo::operator[]
typedef int ( ::SireVol::GridInfo::*__getitem___function_type )( ::SireVol::GridIndex const & ) const;
__getitem___function_type __getitem___function_value( &::SireVol::GridInfo::operator[] );
GridInfo_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("idx") ) );
}
{ //::SireVol::GridInfo::operator[]
typedef int ( ::SireVol::GridInfo::*__getitem___function_type )( ::SireMaths::Vector const & ) const;
__getitem___function_type __getitem___function_value( &::SireVol::GridInfo::operator[] );
GridInfo_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("point") ) );
}
{ //::SireVol::GridInfo::point
typedef ::SireMaths::Vector ( ::SireVol::GridInfo::*point_function_type )( int ) const;
point_function_type point_function_value( &::SireVol::GridInfo::point );
GridInfo_exposer.def(
"point"
, point_function_value
, ( bp::arg("i") ) );
}
{ //::SireVol::GridInfo::point
typedef ::SireMaths::Vector ( ::SireVol::GridInfo::*point_function_type )( ::SireVol::GridIndex const & ) const;
point_function_type point_function_value( &::SireVol::GridInfo::point );
GridInfo_exposer.def(
"point"
, point_function_value
, ( bp::arg("idx") ) );
}
{ //::SireVol::GridInfo::point
typedef ::SireMaths::Vector ( ::SireVol::GridInfo::*point_function_type )( ::SireMaths::Vector const & ) const;
point_function_type point_function_value( &::SireVol::GridInfo::point );
GridInfo_exposer.def(
"point"
, point_function_value
, ( bp::arg("point") ) );
}
{ //::SireVol::GridInfo::pointToArrayIndex
typedef int ( ::SireVol::GridInfo::*pointToArrayIndex_function_type )( ::SireMaths::Vector const & ) const;
pointToArrayIndex_function_type pointToArrayIndex_function_value( &::SireVol::GridInfo::pointToArrayIndex );
GridInfo_exposer.def(
"pointToArrayIndex"
, pointToArrayIndex_function_value
, ( bp::arg("point") ) );
}
{ //::SireVol::GridInfo::pointToGridCorners
typedef void ( ::SireVol::GridInfo::*pointToGridCorners_function_type )( ::SireMaths::Vector const &,::QVector< int > & ) const;
pointToGridCorners_function_type pointToGridCorners_function_value( &::SireVol::GridInfo::pointToGridCorners );
GridInfo_exposer.def(
"pointToGridCorners"
, pointToGridCorners_function_value
, ( bp::arg("point"), bp::arg("indicies") ) );
}
{ //::SireVol::GridInfo::pointToGridCorners
typedef void ( ::SireVol::GridInfo::*pointToGridCorners_function_type )( ::SireMaths::Vector const &,::QVector< int > &,::QVector< float > & ) const;
pointToGridCorners_function_type pointToGridCorners_function_value( &::SireVol::GridInfo::pointToGridCorners );
GridInfo_exposer.def(
"pointToGridCorners"
, pointToGridCorners_function_value
, ( bp::arg("point"), bp::arg("indicies"), bp::arg("weights") ) );
}
{ //::SireVol::GridInfo::pointToGridCorners
typedef int ( ::SireVol::GridInfo::*pointToGridCorners_function_type )( ::SireMaths::MultiFloat const &,::SireMaths::MultiFloat const &,::SireMaths::MultiFloat const &,::QVector< SireMaths::MultiInt > & ) const;
pointToGridCorners_function_type pointToGridCorners_function_value( &::SireVol::GridInfo::pointToGridCorners );
GridInfo_exposer.def(
"pointToGridCorners"
, pointToGridCorners_function_value
, ( bp::arg("x"), bp::arg("y"), bp::arg("z"), bp::arg("indicies") ) );
}
{ //::SireVol::GridInfo::pointToGridCorners
typedef int ( ::SireVol::GridInfo::*pointToGridCorners_function_type )( ::SireMaths::MultiFloat const &,::SireMaths::MultiFloat const &,::SireMaths::MultiFloat const &,::QVector< SireMaths::MultiInt > &,::QVector< SireMaths::MultiFloat > & ) const;
pointToGridCorners_function_type pointToGridCorners_function_value( &::SireVol::GridInfo::pointToGridCorners );
GridInfo_exposer.def(
"pointToGridCorners"
, pointToGridCorners_function_value
, ( bp::arg("x"), bp::arg("y"), bp::arg("z"), bp::arg("indicies"), bp::arg("weights") ) );
}
{ //::SireVol::GridInfo::pointToGridIndex
typedef ::SireVol::GridIndex ( ::SireVol::GridInfo::*pointToGridIndex_function_type )( ::SireMaths::Vector const & ) const;
pointToGridIndex_function_type pointToGridIndex_function_value( &::SireVol::GridInfo::pointToGridIndex );
GridInfo_exposer.def(
"pointToGridIndex"
, pointToGridIndex_function_value
, ( bp::arg("point") ) );
}
{ //::SireVol::GridInfo::redimension
typedef ::QVector< float > ( ::SireVol::GridInfo::*redimension_function_type )( ::QVector< float > const &,::SireVol::GridInfo const & ) const;
redimension_function_type redimension_function_value( &::SireVol::GridInfo::redimension );
GridInfo_exposer.def(
"redimension"
, redimension_function_value
, ( bp::arg("values"), bp::arg("new_grid") ) );
}
{ //::SireVol::GridInfo::size
typedef int ( ::SireVol::GridInfo::*size_function_type )( ) const;
size_function_type size_function_value( &::SireVol::GridInfo::size );
GridInfo_exposer.def(
"size"
, size_function_value );
}
{ //::SireVol::GridInfo::spacing
typedef ::SireUnits::Dimension::Length ( ::SireVol::GridInfo::*spacing_function_type )( ) const;
spacing_function_type spacing_function_value( &::SireVol::GridInfo::spacing );
GridInfo_exposer.def(
"spacing"
, spacing_function_value );
}
{ //::SireVol::GridInfo::toString
typedef ::QString ( ::SireVol::GridInfo::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireVol::GridInfo::toString );
GridInfo_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireVol::GridInfo::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireVol::GridInfo::typeName );
GridInfo_exposer.def(
"typeName"
, typeName_function_value );
}
{ //::SireVol::GridInfo::what
typedef char const * ( ::SireVol::GridInfo::*what_function_type )( ) const;
what_function_type what_function_value( &::SireVol::GridInfo::what );
GridInfo_exposer.def(
"what"
, what_function_value );
}
GridInfo_exposer.staticmethod( "typeName" );
GridInfo_exposer.def( "__copy__", &__copy__);
GridInfo_exposer.def( "__deepcopy__", &__copy__);
GridInfo_exposer.def( "clone", &__copy__);
GridInfo_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireVol::GridInfo >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
GridInfo_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireVol::GridInfo >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
GridInfo_exposer.def( "__str__", &__str__< ::SireVol::GridInfo > );
GridInfo_exposer.def( "__repr__", &__str__< ::SireVol::GridInfo > );
GridInfo_exposer.def( "__len__", &__len_size< ::SireVol::GridInfo > );
GridInfo_exposer.def( "__getitem__", &::SireVol::GridInfo::getitem );
}
}
void register_TI_class(){
{ //::SireAnalysis::TI
typedef bp::class_< SireAnalysis::TI, bp::bases< SireBase::Property > > TI_exposer_t;
TI_exposer_t TI_exposer = TI_exposer_t( "TI", bp::init< >() );
bp::scope TI_scope( TI_exposer );
TI_exposer.def( bp::init< SireAnalysis::Gradients const & >(( bp::arg("gradients") )) );
TI_exposer.def( bp::init< QList< SireAnalysis::Gradients > const & >(( bp::arg("gradients") )) );
TI_exposer.def( bp::init< SireAnalysis::TI const & >(( bp::arg("other") )) );
{ //::SireAnalysis::TI::add
typedef void ( ::SireAnalysis::TI::*add_function_type )( ::QMap< double, SireMaths::AverageAndStddev > const & ) ;
add_function_type add_function_value( &::SireAnalysis::TI::add );
TI_exposer.def(
"add"
, add_function_value
, ( bp::arg("gradients") ) );
}
{ //::SireAnalysis::TI::add
typedef void ( ::SireAnalysis::TI::*add_function_type )( ::QMap< double, SireMaths::FreeEnergyAverage > const & ) ;
add_function_type add_function_value( &::SireAnalysis::TI::add );
TI_exposer.def(
"add"
, add_function_value
, ( bp::arg("gradients") ) );
}
{ //::SireAnalysis::TI::add
typedef void ( ::SireAnalysis::TI::*add_function_type )( ::QMap< double, SireMaths::FreeEnergyAverage > const &,double ) ;
add_function_type add_function_value( &::SireAnalysis::TI::add );
TI_exposer.def(
"add"
, add_function_value
, ( bp::arg("gradients"), bp::arg("delta_lambda") ) );
}
{ //::SireAnalysis::TI::add
typedef void ( ::SireAnalysis::TI::*add_function_type )( ::QMap< double, SireMaths::FreeEnergyAverage > const &,::QMap< double, SireMaths::FreeEnergyAverage > const &,double ) ;
add_function_type add_function_value( &::SireAnalysis::TI::add );
TI_exposer.def(
"add"
, add_function_value
, ( bp::arg("forwards"), bp::arg("backwards"), bp::arg("delta_lambda") ) );
}
{ //::SireAnalysis::TI::add
typedef void ( ::SireAnalysis::TI::*add_function_type )( ::SireAnalysis::Gradients const & ) ;
add_function_type add_function_value( &::SireAnalysis::TI::add );
TI_exposer.def(
"add"
, add_function_value
, ( bp::arg("gradients") ) );
}
{ //::SireAnalysis::TI::at
typedef ::SireAnalysis::Gradients ( ::SireAnalysis::TI::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireAnalysis::TI::at );
TI_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") ) );
}
{ //::SireAnalysis::TI::clear
typedef void ( ::SireAnalysis::TI::*clear_function_type )( ) ;
clear_function_type clear_function_value( &::SireAnalysis::TI::clear );
TI_exposer.def(
"clear"
, clear_function_value );
}
{ //::SireAnalysis::TI::count
typedef int ( ::SireAnalysis::TI::*count_function_type )( ) const;
count_function_type count_function_value( &::SireAnalysis::TI::count );
TI_exposer.def(
"count"
, count_function_value );
}
{ //::SireAnalysis::TI::gradients
typedef ::QList< SireAnalysis::Gradients > ( ::SireAnalysis::TI::*gradients_function_type )( ) const;
gradients_function_type gradients_function_value( &::SireAnalysis::TI::gradients );
TI_exposer.def(
"gradients"
, gradients_function_value );
}
{ //::SireAnalysis::TI::lambdaValues
typedef ::QList< double > ( ::SireAnalysis::TI::*lambdaValues_function_type )( ) const;
lambdaValues_function_type lambdaValues_function_value( &::SireAnalysis::TI::lambdaValues );
TI_exposer.def(
"lambdaValues"
, lambdaValues_function_value );
}
{ //::SireAnalysis::TI::merge
typedef ::SireAnalysis::Gradients ( ::SireAnalysis::TI::*merge_function_type )( int,int ) const;
merge_function_type merge_function_value( &::SireAnalysis::TI::merge );
TI_exposer.def(
"merge"
, merge_function_value
, ( bp::arg("start"), bp::arg("end") ) );
}
{ //::SireAnalysis::TI::merge
typedef ::SireAnalysis::Gradients ( ::SireAnalysis::TI::*merge_function_type )( ::QList< int > ) const;
merge_function_type merge_function_value( &::SireAnalysis::TI::merge );
TI_exposer.def(
"merge"
, merge_function_value
, ( bp::arg("indicies") ) );
}
{ //::SireAnalysis::TI::nIterations
typedef int ( ::SireAnalysis::TI::*nIterations_function_type )( ) const;
nIterations_function_type nIterations_function_value( &::SireAnalysis::TI::nIterations );
TI_exposer.def(
"nIterations"
, nIterations_function_value );
}
{ //::SireAnalysis::TI::nLambdaValues
typedef int ( ::SireAnalysis::TI::*nLambdaValues_function_type )( ) const;
nLambdaValues_function_type nLambdaValues_function_value( &::SireAnalysis::TI::nLambdaValues );
TI_exposer.def(
"nLambdaValues"
, nLambdaValues_function_value );
}
{ //::SireAnalysis::TI::nSamples
typedef ::qint64 ( ::SireAnalysis::TI::*nSamples_function_type )( ) const;
nSamples_function_type nSamples_function_value( &::SireAnalysis::TI::nSamples );
TI_exposer.def(
"nSamples"
, nSamples_function_value );
}
TI_exposer.def( bp::self != bp::self );
{ //::SireAnalysis::TI::operator=
typedef ::SireAnalysis::TI & ( ::SireAnalysis::TI::*assign_function_type )( ::SireAnalysis::TI const & ) ;
assign_function_type assign_function_value( &::SireAnalysis::TI::operator= );
TI_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
TI_exposer.def( bp::self == bp::self );
{ //::SireAnalysis::TI::operator[]
typedef ::SireAnalysis::Gradients ( ::SireAnalysis::TI::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireAnalysis::TI::operator[] );
TI_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") ) );
}
{ //::SireAnalysis::TI::removeAt
typedef void ( ::SireAnalysis::TI::*removeAt_function_type )( int ) ;
removeAt_function_type removeAt_function_value( &::SireAnalysis::TI::removeAt );
TI_exposer.def(
"removeAt"
, removeAt_function_value
, ( bp::arg("i") ) );
}
{ //::SireAnalysis::TI::removeRange
typedef void ( ::SireAnalysis::TI::*removeRange_function_type )( int,int ) ;
removeRange_function_type removeRange_function_value( &::SireAnalysis::TI::removeRange );
TI_exposer.def(
"removeRange"
, removeRange_function_value
, ( bp::arg("start"), bp::arg("end") ) );
}
{ //::SireAnalysis::TI::rollingAverage
typedef ::QList< SireAnalysis::Gradients > ( ::SireAnalysis::TI::*rollingAverage_function_type )( int ) const;
rollingAverage_function_type rollingAverage_function_value( &::SireAnalysis::TI::rollingAverage );
TI_exposer.def(
"rollingAverage"
, rollingAverage_function_value
, ( bp::arg("niterations") ) );
}
{ //::SireAnalysis::TI::set
typedef void ( ::SireAnalysis::TI::*set_function_type )( int,::QMap< double, SireMaths::AverageAndStddev > const & ) ;
set_function_type set_function_value( &::SireAnalysis::TI::set );
TI_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("gradients") ) );
}
{ //::SireAnalysis::TI::set
typedef void ( ::SireAnalysis::TI::*set_function_type )( int,::QMap< double, SireMaths::FreeEnergyAverage > const & ) ;
set_function_type set_function_value( &::SireAnalysis::TI::set );
TI_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("gradients") ) );
}
{ //::SireAnalysis::TI::set
typedef void ( ::SireAnalysis::TI::*set_function_type )( int,::QMap< double, SireMaths::FreeEnergyAverage > const &,double ) ;
set_function_type set_function_value( &::SireAnalysis::TI::set );
TI_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("gradients"), bp::arg("delta_lambda") ) );
}
{ //::SireAnalysis::TI::set
typedef void ( ::SireAnalysis::TI::*set_function_type )( int,::QMap< double, SireMaths::FreeEnergyAverage > const &,::QMap< double, SireMaths::FreeEnergyAverage > const &,double ) ;
set_function_type set_function_value( &::SireAnalysis::TI::set );
TI_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("forwards"), bp::arg("backwards"), bp::arg("delta_lambda") ) );
}
{ //::SireAnalysis::TI::set
typedef void ( ::SireAnalysis::TI::*set_function_type )( int,::SireAnalysis::Gradients const & ) ;
set_function_type set_function_value( &::SireAnalysis::TI::set );
TI_exposer.def(
"set"
, set_function_value
, ( bp::arg("i"), bp::arg("gradients") ) );
}
{ //::SireAnalysis::TI::size
typedef int ( ::SireAnalysis::TI::*size_function_type )( ) const;
size_function_type size_function_value( &::SireAnalysis::TI::size );
TI_exposer.def(
"size"
, size_function_value );
}
{ //::SireAnalysis::TI::toString
typedef ::QString ( ::SireAnalysis::TI::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireAnalysis::TI::toString );
TI_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireAnalysis::TI::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireAnalysis::TI::typeName );
TI_exposer.def(
"typeName"
, typeName_function_value );
}
{ //::SireAnalysis::TI::what
typedef char const * ( ::SireAnalysis::TI::*what_function_type )( ) const;
what_function_type what_function_value( &::SireAnalysis::TI::what );
TI_exposer.def(
"what"
, what_function_value );
}
TI_exposer.staticmethod( "typeName" );
TI_exposer.def( "__copy__", &__copy__);
TI_exposer.def( "__deepcopy__", &__copy__);
TI_exposer.def( "clone", &__copy__);
TI_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireAnalysis::TI >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
TI_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireAnalysis::TI >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
TI_exposer.def( "__str__", &__str__< ::SireAnalysis::TI > );
TI_exposer.def( "__repr__", &__str__< ::SireAnalysis::TI > );
TI_exposer.def( "__len__", &__len_size< ::SireAnalysis::TI > );
}
}
void register_CLJWorkspace_class(){
{ //::SireMM::CLJWorkspace
typedef bp::class_< SireMM::CLJWorkspace > CLJWorkspace_exposer_t;
CLJWorkspace_exposer_t CLJWorkspace_exposer = CLJWorkspace_exposer_t( "CLJWorkspace", "This class provides a workspace in which to hold the details of the changes\nthat occur in a CLJ forcefield during a Monte Carlo move. The class is optimised\nto avoid copying or duplicating data during Sires copy-on-write copying\n(e.g. the memory allocated in a workspace will always be available for the\nnew copy of a forcefield rather than the old, which, if things work correctly,\nwill mean that there should be no memory allocation during simple MC moves...)\n\nAuthor: Christopher Woods\n", bp::init< >("Constructor") );
bp::scope CLJWorkspace_scope( CLJWorkspace_exposer );
CLJWorkspace_exposer.def( bp::init< SireMM::CLJWorkspace const & >(( bp::arg("other") ), "Copy constructor") );
{ //::SireMM::CLJWorkspace::accept
typedef void ( ::SireMM::CLJWorkspace::*accept_function_type)( ::SireMM::CLJBoxes & ) ;
accept_function_type accept_function_value( &::SireMM::CLJWorkspace::accept );
CLJWorkspace_exposer.def(
"accept"
, accept_function_value
, ( bp::arg("boxes") )
, "Accept this workspace - this clears the recalc_from_scratch flag as it\nsignals that we have put the CLJBoxes into a sane state" );
}
{ //::SireMM::CLJWorkspace::at
typedef ::SireMM::CLJDelta const & ( ::SireMM::CLJWorkspace::*at_function_type)( int ) const;
at_function_type at_function_value( &::SireMM::CLJWorkspace::at );
CLJWorkspace_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "Return the ith delta" );
}
{ //::SireMM::CLJWorkspace::changedAtoms
typedef ::SireMM::CLJAtoms ( ::SireMM::CLJWorkspace::*changedAtoms_function_type)( ) const;
changedAtoms_function_type changedAtoms_function_value( &::SireMM::CLJWorkspace::changedAtoms );
CLJWorkspace_exposer.def(
"changedAtoms"
, changedAtoms_function_value
, "Merge all of the deltas together into a single set of changed CLJAtoms that\ncan be used for the change in energy calculation" );
}
{ //::SireMM::CLJWorkspace::clear
typedef void ( ::SireMM::CLJWorkspace::*clear_function_type)( ) ;
clear_function_type clear_function_value( &::SireMM::CLJWorkspace::clear );
CLJWorkspace_exposer.def(
"clear"
, clear_function_value
, "Clear this workspace" );
}
{ //::SireMM::CLJWorkspace::commit
typedef ::QVector< SireMM::CLJBoxIndex > ( ::SireMM::CLJWorkspace::*commit_function_type)( ::SireMM::CLJBoxes &,::SireMM::CLJDelta const & ) ;
commit_function_type commit_function_value( &::SireMM::CLJWorkspace::commit );
CLJWorkspace_exposer.def(
"commit"
, commit_function_value
, ( bp::arg("boxes"), bp::arg("delta") )
, "Commit the changes in the passed delta into the passed CLJBoxes" );
}
{ //::SireMM::CLJWorkspace::count
typedef int ( ::SireMM::CLJWorkspace::*count_function_type)( ) const;
count_function_type count_function_value( &::SireMM::CLJWorkspace::count );
CLJWorkspace_exposer.def(
"count"
, count_function_value
, "Return the number of deltas" );
}
{ //::SireMM::CLJWorkspace::getitem
typedef ::SireMM::CLJDelta ( ::SireMM::CLJWorkspace::*getitem_function_type)( int ) const;
getitem_function_type getitem_function_value( &::SireMM::CLJWorkspace::getitem );
CLJWorkspace_exposer.def(
"getitem"
, getitem_function_value
, ( bp::arg("i") )
, "Return the ith delta" );
}
{ //::SireMM::CLJWorkspace::isEmpty
typedef bool ( ::SireMM::CLJWorkspace::*isEmpty_function_type)( ) const;
isEmpty_function_type isEmpty_function_value( &::SireMM::CLJWorkspace::isEmpty );
CLJWorkspace_exposer.def(
"isEmpty"
, isEmpty_function_value
, "Return whether or not this workspace is empty" );
}
{ //::SireMM::CLJWorkspace::isSingleID
typedef bool ( ::SireMM::CLJWorkspace::*isSingleID_function_type)( ) const;
isSingleID_function_type isSingleID_function_value( &::SireMM::CLJWorkspace::isSingleID );
CLJWorkspace_exposer.def(
"isSingleID"
, isSingleID_function_value
, "Return whether or not this workspace contains deltas with a single\nID (a single CLJAtoms ID)" );
}
{ //::SireMM::CLJWorkspace::merge
typedef ::boost::tuples::tuple< SireMM::CLJAtoms, SireMM::CLJAtoms, SireMM::CLJAtoms, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type > ( ::SireMM::CLJWorkspace::*merge_function_type)( ) const;
merge_function_type merge_function_value( &::SireMM::CLJWorkspace::merge );
CLJWorkspace_exposer.def(
"merge"
, merge_function_value
, "Merge all of the deltas together to return the tuple of the\nchanged, old and new atoms. This is equivalent to calling\nchangedAtoms(), oldAtoms() and newAtoms() and placing them\ninto a tuple. This is more efficient than three separate calls" );
}
{ //::SireMM::CLJWorkspace::mustRecalculateFromScratch
typedef void ( ::SireMM::CLJWorkspace::*mustRecalculateFromScratch_function_type)( ::SireMM::CLJBoxes & ) ;
mustRecalculateFromScratch_function_type mustRecalculateFromScratch_function_value( &::SireMM::CLJWorkspace::mustRecalculateFromScratch );
CLJWorkspace_exposer.def(
"mustRecalculateFromScratch"
, mustRecalculateFromScratch_function_value
, ( bp::arg("boxes") )
, "Tell the workspace that we are now recalculating everything from scratch" );
}
{ //::SireMM::CLJWorkspace::nDeltas
typedef int ( ::SireMM::CLJWorkspace::*nDeltas_function_type)( ) const;
nDeltas_function_type nDeltas_function_value( &::SireMM::CLJWorkspace::nDeltas );
CLJWorkspace_exposer.def(
"nDeltas"
, nDeltas_function_value
, "Return the number of deltas in this workspace" );
}
{ //::SireMM::CLJWorkspace::needsAccepting
typedef bool ( ::SireMM::CLJWorkspace::*needsAccepting_function_type)( ) const;
needsAccepting_function_type needsAccepting_function_value( &::SireMM::CLJWorkspace::needsAccepting );
CLJWorkspace_exposer.def(
"needsAccepting"
, needsAccepting_function_value
, "Return whether or not this workspace needs accepting" );
}
{ //::SireMM::CLJWorkspace::newAtoms
typedef ::SireMM::CLJAtoms ( ::SireMM::CLJWorkspace::*newAtoms_function_type)( ) const;
newAtoms_function_type newAtoms_function_value( &::SireMM::CLJWorkspace::newAtoms );
CLJWorkspace_exposer.def(
"newAtoms"
, newAtoms_function_value
, "Merge all of the new atoms from the deltas together into a single\nset of new CLJAtoms that can be used for the change in energy calculation" );
}
{ //::SireMM::CLJWorkspace::oldAtoms
typedef ::SireMM::CLJAtoms ( ::SireMM::CLJWorkspace::*oldAtoms_function_type)( ) const;
oldAtoms_function_type oldAtoms_function_value( &::SireMM::CLJWorkspace::oldAtoms );
CLJWorkspace_exposer.def(
"oldAtoms"
, oldAtoms_function_value
, "Merge all of the old atoms from the deltas together into a single\nset of old CLJAtoms that can be used for the change in energy calculation" );
}
CLJWorkspace_exposer.def( bp::self != bp::self );
{ //::SireMM::CLJWorkspace::operator=
typedef ::SireMM::CLJWorkspace & ( ::SireMM::CLJWorkspace::*assign_function_type)( ::SireMM::CLJWorkspace const & ) ;
assign_function_type assign_function_value( &::SireMM::CLJWorkspace::operator= );
CLJWorkspace_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >()
, "" );
}
CLJWorkspace_exposer.def( bp::self == bp::self );
{ //::SireMM::CLJWorkspace::operator[]
typedef ::SireMM::CLJDelta const & ( ::SireMM::CLJWorkspace::*__getitem___function_type)( int ) const;
__getitem___function_type __getitem___function_value( &::SireMM::CLJWorkspace::operator[] );
CLJWorkspace_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >()
, "" );
}
{ //::SireMM::CLJWorkspace::push
typedef ::SireMM::CLJDelta ( ::SireMM::CLJWorkspace::*push_function_type)( ::SireMM::CLJBoxes &,::QVector< SireMM::CLJBoxIndex > const &,::SireMM::CLJAtoms const &,::SireMM::CLJDelta const & ) ;
push_function_type push_function_value( &::SireMM::CLJWorkspace::push );
CLJWorkspace_exposer.def(
"push"
, push_function_value
, ( bp::arg("boxes"), bp::arg("old_atoms"), bp::arg("new_atoms"), bp::arg("old_delta") )
, "Push the passed change onto the workspace. This changes the atoms in the\npassed CLJBoxes from their values in old_atoms to their values in the\npassed new_atoms. The last CLJDelta used for these atoms is supplied as\nold_delta, and this returns the new CLJDelta for these atoms." );
}
{ //::SireMM::CLJWorkspace::recalculatingFromScratch
typedef bool ( ::SireMM::CLJWorkspace::*recalculatingFromScratch_function_type)( ) const;
recalculatingFromScratch_function_type recalculatingFromScratch_function_value( &::SireMM::CLJWorkspace::recalculatingFromScratch );
CLJWorkspace_exposer.def(
"recalculatingFromScratch"
, recalculatingFromScratch_function_value
, "Return whether or not we are recalculating everything from scratch" );
}
{ //::SireMM::CLJWorkspace::removeSameIDAtoms
typedef void ( ::SireMM::CLJWorkspace::*removeSameIDAtoms_function_type)( ::SireMM::CLJBoxes & ) ;
removeSameIDAtoms_function_type removeSameIDAtoms_function_value( &::SireMM::CLJWorkspace::removeSameIDAtoms );
CLJWorkspace_exposer.def(
"removeSameIDAtoms"
, removeSameIDAtoms_function_value
, ( bp::arg("boxes") )
, "Internal function used to fully remove atoms that have not been\nremoved because they all have the same ID. This is used when the\noptimisation of not removing same ID atoms would break the energy\ncalculation, e.g. if we have multiple CLJGroups and have multiple\nchanged IDs across these groups" );
}
{ //::SireMM::CLJWorkspace::revert
typedef ::QVector< SireMM::CLJBoxIndex > ( ::SireMM::CLJWorkspace::*revert_function_type)( ::SireMM::CLJBoxes &,::SireMM::CLJDelta const & ) ;
revert_function_type revert_function_value( &::SireMM::CLJWorkspace::revert );
CLJWorkspace_exposer.def(
"revert"
, revert_function_value
, ( bp::arg("boxes"), bp::arg("delta") )
, "Revert the changes supplied in the passed delta" );
}
{ //::SireMM::CLJWorkspace::size
typedef int ( ::SireMM::CLJWorkspace::*size_function_type)( ) const;
size_function_type size_function_value( &::SireMM::CLJWorkspace::size );
CLJWorkspace_exposer.def(
"size"
, size_function_value
, "Return the number of deltas" );
}
{ //::SireMM::CLJWorkspace::toString
typedef ::QString ( ::SireMM::CLJWorkspace::*toString_function_type)( ) const;
toString_function_type toString_function_value( &::SireMM::CLJWorkspace::toString );
CLJWorkspace_exposer.def(
"toString"
, toString_function_value
, "" );
}
{ //::SireMM::CLJWorkspace::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMM::CLJWorkspace::typeName );
CLJWorkspace_exposer.def(
"typeName"
, typeName_function_value
, "" );
}
{ //::SireMM::CLJWorkspace::what
typedef char const * ( ::SireMM::CLJWorkspace::*what_function_type)( ) const;
what_function_type what_function_value( &::SireMM::CLJWorkspace::what );
CLJWorkspace_exposer.def(
"what"
, what_function_value
, "" );
}
CLJWorkspace_exposer.staticmethod( "typeName" );
CLJWorkspace_exposer.def( "__copy__", &__copy__);
CLJWorkspace_exposer.def( "__deepcopy__", &__copy__);
CLJWorkspace_exposer.def( "clone", &__copy__);
CLJWorkspace_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMM::CLJWorkspace >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
CLJWorkspace_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMM::CLJWorkspace >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
CLJWorkspace_exposer.def( "__str__", &__str__< ::SireMM::CLJWorkspace > );
CLJWorkspace_exposer.def( "__repr__", &__str__< ::SireMM::CLJWorkspace > );
CLJWorkspace_exposer.def( "__len__", &__len_size< ::SireMM::CLJWorkspace > );
CLJWorkspace_exposer.def( "__getitem__", &::SireMM::CLJWorkspace::getitem );
}
}
void register_PropertyList_class(){
{ //::SireBase::PropertyList
typedef bp::class_< SireBase::PropertyList, bp::bases< SireBase::Property > > PropertyList_exposer_t;
PropertyList_exposer_t PropertyList_exposer = PropertyList_exposer_t( "PropertyList", bp::init< >() );
bp::scope PropertyList_scope( PropertyList_exposer );
PropertyList_exposer.def( bp::init< QList< SireBase::PropPtr< SireBase::Property > > const & >(( bp::arg("props") )) );
PropertyList_exposer.def( bp::init< SireBase::PropertyList const & >(( bp::arg("other") )) );
{ //::SireBase::PropertyList::append
typedef void ( ::SireBase::PropertyList::*append_function_type )( ::SireBase::Property const & ) ;
append_function_type append_function_value( &::SireBase::PropertyList::append );
PropertyList_exposer.def(
"append"
, append_function_value
, ( bp::arg("property") ) );
}
{ //::SireBase::PropertyList::append
typedef void ( ::SireBase::PropertyList::*append_function_type )( ::QList< SireBase::PropPtr< SireBase::Property > > const & ) ;
append_function_type append_function_value( &::SireBase::PropertyList::append );
PropertyList_exposer.def(
"append"
, append_function_value
, ( bp::arg("props") ) );
}
{ //::SireBase::PropertyList::array
typedef ::QList< SireBase::PropPtr< SireBase::Property > > ( ::SireBase::PropertyList::*array_function_type )( ) const;
array_function_type array_function_value( &::SireBase::PropertyList::array );
PropertyList_exposer.def(
"array"
, array_function_value );
}
{ //::SireBase::PropertyList::at
typedef ::SireBase::Property const & ( ::SireBase::PropertyList::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireBase::PropertyList::at );
PropertyList_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireBase::PropertyList::clear
typedef void ( ::SireBase::PropertyList::*clear_function_type )( ) ;
clear_function_type clear_function_value( &::SireBase::PropertyList::clear );
PropertyList_exposer.def(
"clear"
, clear_function_value );
}
{ //::SireBase::PropertyList::count
typedef int ( ::SireBase::PropertyList::*count_function_type )( ) const;
count_function_type count_function_value( &::SireBase::PropertyList::count );
PropertyList_exposer.def(
"count"
, count_function_value );
}
{ //::SireBase::PropertyList::empty
typedef bool ( ::SireBase::PropertyList::*empty_function_type )( ) const;
empty_function_type empty_function_value( &::SireBase::PropertyList::empty );
PropertyList_exposer.def(
"empty"
, empty_function_value );
}
{ //::SireBase::PropertyList::insert
typedef void ( ::SireBase::PropertyList::*insert_function_type )( int,::SireBase::Property const & ) ;
insert_function_type insert_function_value( &::SireBase::PropertyList::insert );
PropertyList_exposer.def(
"insert"
, insert_function_value
, ( bp::arg("i"), bp::arg("value") ) );
}
{ //::SireBase::PropertyList::isEmpty
typedef bool ( ::SireBase::PropertyList::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireBase::PropertyList::isEmpty );
PropertyList_exposer.def(
"isEmpty"
, isEmpty_function_value );
}
{ //::SireBase::PropertyList::mid
typedef ::SireBase::PropertyList ( ::SireBase::PropertyList::*mid_function_type )( int,int ) const;
mid_function_type mid_function_value( &::SireBase::PropertyList::mid );
PropertyList_exposer.def(
"mid"
, mid_function_value
, ( bp::arg("pos"), bp::arg("length")=(int)(-0x00000000000000001) ) );
}
{ //::SireBase::PropertyList::move
typedef void ( ::SireBase::PropertyList::*move_function_type )( int,int ) ;
move_function_type move_function_value( &::SireBase::PropertyList::move );
PropertyList_exposer.def(
"move"
, move_function_value
, ( bp::arg("from"), bp::arg("to") ) );
}
PropertyList_exposer.def( bp::self != bp::self );
PropertyList_exposer.def( bp::self + bp::self );
{ //::SireBase::PropertyList::operator=
typedef ::SireBase::PropertyList & ( ::SireBase::PropertyList::*assign_function_type )( ::SireBase::PropertyList const & ) ;
assign_function_type assign_function_value( &::SireBase::PropertyList::operator= );
PropertyList_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
PropertyList_exposer.def( bp::self == bp::self );
{ //::SireBase::PropertyList::operator[]
typedef ::SireBase::Property const & ( ::SireBase::PropertyList::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireBase::PropertyList::operator[] );
PropertyList_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireBase::PropertyList::pop_back
typedef void ( ::SireBase::PropertyList::*pop_back_function_type )( ) ;
pop_back_function_type pop_back_function_value( &::SireBase::PropertyList::pop_back );
PropertyList_exposer.def(
"pop_back"
, pop_back_function_value );
}
{ //::SireBase::PropertyList::pop_front
typedef void ( ::SireBase::PropertyList::*pop_front_function_type )( ) ;
pop_front_function_type pop_front_function_value( &::SireBase::PropertyList::pop_front );
PropertyList_exposer.def(
"pop_front"
, pop_front_function_value );
}
{ //::SireBase::PropertyList::prepend
typedef void ( ::SireBase::PropertyList::*prepend_function_type )( ::SireBase::Property const & ) ;
prepend_function_type prepend_function_value( &::SireBase::PropertyList::prepend );
PropertyList_exposer.def(
"prepend"
, prepend_function_value
, ( bp::arg("value") ) );
}
{ //::SireBase::PropertyList::push_back
typedef void ( ::SireBase::PropertyList::*push_back_function_type )( ::SireBase::Property const & ) ;
push_back_function_type push_back_function_value( &::SireBase::PropertyList::push_back );
PropertyList_exposer.def(
"push_back"
, push_back_function_value
, ( bp::arg("value") ) );
}
{ //::SireBase::PropertyList::push_front
typedef void ( ::SireBase::PropertyList::*push_front_function_type )( ::SireBase::Property const & ) ;
push_front_function_type push_front_function_value( &::SireBase::PropertyList::push_front );
PropertyList_exposer.def(
"push_front"
, push_front_function_value
, ( bp::arg("value") ) );
}
{ //::SireBase::PropertyList::removeAt
typedef void ( ::SireBase::PropertyList::*removeAt_function_type )( int ) ;
removeAt_function_type removeAt_function_value( &::SireBase::PropertyList::removeAt );
PropertyList_exposer.def(
"removeAt"
, removeAt_function_value
, ( bp::arg("i") ) );
}
{ //::SireBase::PropertyList::removeFirst
typedef void ( ::SireBase::PropertyList::*removeFirst_function_type )( ) ;
removeFirst_function_type removeFirst_function_value( &::SireBase::PropertyList::removeFirst );
PropertyList_exposer.def(
"removeFirst"
, removeFirst_function_value );
}
{ //::SireBase::PropertyList::removeLast
typedef void ( ::SireBase::PropertyList::*removeLast_function_type )( ) ;
removeLast_function_type removeLast_function_value( &::SireBase::PropertyList::removeLast );
PropertyList_exposer.def(
"removeLast"
, removeLast_function_value );
}
{ //::SireBase::PropertyList::replace
typedef void ( ::SireBase::PropertyList::*replace_function_type )( int,::SireBase::Property const & ) ;
replace_function_type replace_function_value( &::SireBase::PropertyList::replace );
PropertyList_exposer.def(
"replace"
, replace_function_value
, ( bp::arg("i"), bp::arg("value") ) );
}
{ //::SireBase::PropertyList::size
typedef int ( ::SireBase::PropertyList::*size_function_type )( ) const;
size_function_type size_function_value( &::SireBase::PropertyList::size );
PropertyList_exposer.def(
"size"
, size_function_value );
}
{ //::SireBase::PropertyList::swap
typedef void ( ::SireBase::PropertyList::*swap_function_type )( ::SireBase::PropertyList & ) ;
swap_function_type swap_function_value( &::SireBase::PropertyList::swap );
PropertyList_exposer.def(
"swap"
, swap_function_value
, ( bp::arg("other") ) );
}
{ //::SireBase::PropertyList::swap
typedef void ( ::SireBase::PropertyList::*swap_function_type )( int,int ) ;
swap_function_type swap_function_value( &::SireBase::PropertyList::swap );
PropertyList_exposer.def(
"swap"
, swap_function_value
, ( bp::arg("i"), bp::arg("j") ) );
}
{ //::SireBase::PropertyList::takeAt
typedef ::SireBase::PropertyPtr ( ::SireBase::PropertyList::*takeAt_function_type )( int ) ;
takeAt_function_type takeAt_function_value( &::SireBase::PropertyList::takeAt );
PropertyList_exposer.def(
"takeAt"
, takeAt_function_value
, ( bp::arg("i") ) );
}
{ //::SireBase::PropertyList::takeFirst
typedef ::SireBase::PropertyPtr ( ::SireBase::PropertyList::*takeFirst_function_type )( ) ;
takeFirst_function_type takeFirst_function_value( &::SireBase::PropertyList::takeFirst );
PropertyList_exposer.def(
"takeFirst"
, takeFirst_function_value );
}
{ //::SireBase::PropertyList::takeLast
typedef ::SireBase::PropertyPtr ( ::SireBase::PropertyList::*takeLast_function_type )( ) ;
takeLast_function_type takeLast_function_value( &::SireBase::PropertyList::takeLast );
PropertyList_exposer.def(
"takeLast"
, takeLast_function_value );
}
{ //::SireBase::PropertyList::toList
typedef ::QList< SireBase::PropPtr< SireBase::Property > > ( ::SireBase::PropertyList::*toList_function_type )( ) const;
toList_function_type toList_function_value( &::SireBase::PropertyList::toList );
PropertyList_exposer.def(
"toList"
, toList_function_value );
}
{ //::SireBase::PropertyList::toString
typedef ::QString ( ::SireBase::PropertyList::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireBase::PropertyList::toString );
PropertyList_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireBase::PropertyList::toVector
typedef ::QVector< SireBase::PropPtr< SireBase::Property > > ( ::SireBase::PropertyList::*toVector_function_type )( ) const;
toVector_function_type toVector_function_value( &::SireBase::PropertyList::toVector );
PropertyList_exposer.def(
"toVector"
, toVector_function_value );
}
{ //::SireBase::PropertyList::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireBase::PropertyList::typeName );
PropertyList_exposer.def(
"typeName"
, typeName_function_value );
}
{ //::SireBase::PropertyList::value
typedef ::SireBase::PropertyPtr ( ::SireBase::PropertyList::*value_function_type )( int ) const;
value_function_type value_function_value( &::SireBase::PropertyList::value );
PropertyList_exposer.def(
"value"
, value_function_value
, ( bp::arg("i") ) );
}
{ //::SireBase::PropertyList::value
typedef ::SireBase::PropertyPtr ( ::SireBase::PropertyList::*value_function_type )( int,::SireBase::Property const & ) const;
value_function_type value_function_value( &::SireBase::PropertyList::value );
PropertyList_exposer.def(
"value"
, value_function_value
, ( bp::arg("i"), bp::arg("default_value") ) );
}
PropertyList_exposer.staticmethod( "typeName" );
PropertyList_exposer.def( "__copy__", &__copy__);
PropertyList_exposer.def( "__deepcopy__", &__copy__);
PropertyList_exposer.def( "clone", &__copy__);
PropertyList_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireBase::PropertyList >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
PropertyList_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireBase::PropertyList >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
PropertyList_exposer.def( "__str__", &__str__< ::SireBase::PropertyList > );
PropertyList_exposer.def( "__repr__", &__str__< ::SireBase::PropertyList > );
PropertyList_exposer.def( "__len__", &__len_size< ::SireBase::PropertyList > );
}
}
void register_SegStringProperty_class(){
{ //::SireMol::SegProperty< QString >
typedef bp::class_< SireMol::SegProperty< QString >, bp::bases< SireMol::SegProp, SireMol::MolViewProperty, SireBase::Property > > SegStringProperty_exposer_t;
SegStringProperty_exposer_t SegStringProperty_exposer = SegStringProperty_exposer_t( "SegStringProperty", bp::init< >() );
bp::scope SegStringProperty_scope( SegStringProperty_exposer );
SegStringProperty_exposer.def( bp::init< SireMol::MoleculeInfoData const & >(( bp::arg("molinfo") )) );
SegStringProperty_exposer.def( bp::init< QVector< QString > const & >(( bp::arg("values") )) );
SegStringProperty_exposer.def( bp::init< SireMol::SegProperty< QString > const & >(( bp::arg("other") )) );
{ //::SireMol::SegProperty< QString >::array
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::QVector< QString > const & ( ::SireMol::SegProperty< QString >::*array_function_type )( ) const;
array_function_type array_function_value( &::SireMol::SegProperty< QString >::array );
SegStringProperty_exposer.def(
"array"
, array_function_value
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::SegProperty< QString >::assertCanConvert
typedef SireMol::SegProperty< QString > exported_class_t;
typedef void ( ::SireMol::SegProperty< QString >::*assertCanConvert_function_type )( ::QVariant const & ) const;
assertCanConvert_function_type assertCanConvert_function_value( &::SireMol::SegProperty< QString >::assertCanConvert );
SegStringProperty_exposer.def(
"assertCanConvert"
, assertCanConvert_function_value
, ( bp::arg("value") ) );
}
{ //::SireMol::SegProperty< QString >::assignFrom
typedef SireMol::SegProperty< QString > exported_class_t;
typedef void ( ::SireMol::SegProperty< QString >::*assignFrom_function_type )( ::SireMol::SegProperty< QVariant > const & ) ;
assignFrom_function_type assignFrom_function_value( &::SireMol::SegProperty< QString >::assignFrom );
SegStringProperty_exposer.def(
"assignFrom"
, assignFrom_function_value
, ( bp::arg("values") ) );
}
{ //::SireMol::SegProperty< QString >::at
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::QString const & ( ::SireMol::SegProperty< QString >::*at_function_type )( ::SireMol::SegIdx const & ) const;
at_function_type at_function_value( &::SireMol::SegProperty< QString >::at );
SegStringProperty_exposer.def(
"at"
, at_function_value
, ( bp::arg("segidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::SegProperty< QString >::canConvert
typedef SireMol::SegProperty< QString > exported_class_t;
typedef bool ( ::SireMol::SegProperty< QString >::*canConvert_function_type )( ::QVariant const & ) const;
canConvert_function_type canConvert_function_value( &::SireMol::SegProperty< QString >::canConvert );
SegStringProperty_exposer.def(
"canConvert"
, canConvert_function_value
, ( bp::arg("value") ) );
}
{ //::SireMol::SegProperty< QString >::count
typedef SireMol::SegProperty< QString > exported_class_t;
typedef int ( ::SireMol::SegProperty< QString >::*count_function_type )( ) const;
count_function_type count_function_value( &::SireMol::SegProperty< QString >::count );
SegStringProperty_exposer.def(
"count"
, count_function_value );
}
{ //::SireMol::SegProperty< QString >::fromVariant
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::SireMol::SegProperty< QString > ( *fromVariant_function_type )( ::SireMol::SegProperty< QVariant > const & );
fromVariant_function_type fromVariant_function_value( &::SireMol::SegProperty< QString >::fromVariant );
SegStringProperty_exposer.def(
"fromVariant"
, fromVariant_function_value
, ( bp::arg("values") ) );
}
{ //::SireMol::SegProperty< QString >::get
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::QString const & ( ::SireMol::SegProperty< QString >::*get_function_type )( ::SireMol::SegIdx const & ) const;
get_function_type get_function_value( &::SireMol::SegProperty< QString >::get );
SegStringProperty_exposer.def(
"get"
, get_function_value
, ( bp::arg("segidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::SegProperty< QString >::isCompatibleWith
typedef SireMol::SegProperty< QString > exported_class_t;
typedef bool ( ::SireMol::SegProperty< QString >::*isCompatibleWith_function_type )( ::SireMol::MoleculeInfoData const & ) const;
isCompatibleWith_function_type isCompatibleWith_function_value( &::SireMol::SegProperty< QString >::isCompatibleWith );
SegStringProperty_exposer.def(
"isCompatibleWith"
, isCompatibleWith_function_value
, ( bp::arg("molinfo") ) );
}
{ //::SireMol::SegProperty< QString >::isEmpty
typedef SireMol::SegProperty< QString > exported_class_t;
typedef bool ( ::SireMol::SegProperty< QString >::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireMol::SegProperty< QString >::isEmpty );
SegStringProperty_exposer.def(
"isEmpty"
, isEmpty_function_value );
}
{ //::SireMol::SegProperty< QString >::nSegments
typedef SireMol::SegProperty< QString > exported_class_t;
typedef int ( ::SireMol::SegProperty< QString >::*nSegments_function_type )( ) const;
nSegments_function_type nSegments_function_value( &::SireMol::SegProperty< QString >::nSegments );
SegStringProperty_exposer.def(
"nSegments"
, nSegments_function_value );
}
SegStringProperty_exposer.def( bp::self != bp::self );
{ //::SireMol::SegProperty< QString >::operator=
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::SireMol::SegProperty< QString > & ( ::SireMol::SegProperty< QString >::*assign_function_type )( ::SireMol::SegProperty< QString > const & ) ;
assign_function_type assign_function_value( &::SireMol::SegProperty< QString >::operator= );
SegStringProperty_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
SegStringProperty_exposer.def( bp::self == bp::self );
{ //::SireMol::SegProperty< QString >::operator[]
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::QString const & ( ::SireMol::SegProperty< QString >::*__getitem___function_type )( ::SireMol::SegIdx const & ) const;
__getitem___function_type __getitem___function_value( &::SireMol::SegProperty< QString >::operator[] );
SegStringProperty_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("segidx") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireMol::SegProperty< QString >::set
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::SireMol::SegProperty< QString > & ( ::SireMol::SegProperty< QString >::*set_function_type )( ::SireMol::SegIdx,::QString const & ) ;
set_function_type set_function_value( &::SireMol::SegProperty< QString >::set );
SegStringProperty_exposer.def(
"set"
, set_function_value
, ( bp::arg("segidx"), bp::arg("value") )
, bp::return_self< >() );
}
{ //::SireMol::SegProperty< QString >::size
typedef SireMol::SegProperty< QString > exported_class_t;
typedef int ( ::SireMol::SegProperty< QString >::*size_function_type )( ) const;
size_function_type size_function_value( &::SireMol::SegProperty< QString >::size );
SegStringProperty_exposer.def(
"size"
, size_function_value );
}
{ //::SireMol::SegProperty< QString >::toString
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::QString ( ::SireMol::SegProperty< QString >::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireMol::SegProperty< QString >::toString );
SegStringProperty_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireMol::SegProperty< QString >::toVariant
typedef SireMol::SegProperty< QString > exported_class_t;
typedef ::SireMol::SegProperty< QVariant > ( ::SireMol::SegProperty< QString >::*toVariant_function_type )( ) const;
toVariant_function_type toVariant_function_value( &::SireMol::SegProperty< QString >::toVariant );
SegStringProperty_exposer.def(
"toVariant"
, toVariant_function_value );
}
{ //::SireMol::SegProperty< QString >::typeName
typedef SireMol::SegProperty< QString > exported_class_t;
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMol::SegProperty< QString >::typeName );
SegStringProperty_exposer.def(
"typeName"
, typeName_function_value );
}
SegStringProperty_exposer.staticmethod( "fromVariant" );
SegStringProperty_exposer.staticmethod( "typeName" );
SegStringProperty_exposer.def( "__copy__", &__copy__);
SegStringProperty_exposer.def( "__deepcopy__", &__copy__);
SegStringProperty_exposer.def( "clone", &__copy__);
SegStringProperty_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMol::SegProperty<QString> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
SegStringProperty_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMol::SegProperty<QString> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
SegStringProperty_exposer.def( "__str__", &__str__< ::SireMol::SegProperty<QString> > );
SegStringProperty_exposer.def( "__repr__", &__str__< ::SireMol::SegProperty<QString> > );
SegStringProperty_exposer.def( "__len__", &__len_size< ::SireMol::SegProperty<QString> > );
}
}
void register_ChunkedVector_double__class(){
{ //::SireBase::ChunkedVector< double, 100 >
typedef bp::class_< SireBase::ChunkedVector< double, 100 > > ChunkedVector_double__exposer_t;
ChunkedVector_double__exposer_t ChunkedVector_double__exposer = ChunkedVector_double__exposer_t( "ChunkedVector_double_", bp::init< >() );
bp::scope ChunkedVector_double__scope( ChunkedVector_double__exposer );
{ //::SireBase::ChunkedVector< double, 100 >::const_iterator
typedef bp::class_< SireBase::ChunkedVector< double, 100 >::const_iterator > const_iterator_exposer_t;
const_iterator_exposer_t const_iterator_exposer = const_iterator_exposer_t( "const_iterator", bp::init< >() );
bp::scope const_iterator_scope( const_iterator_exposer );
const_iterator_exposer.def( bp::init< SireBase::ChunkedVector< double, 100 >::const_iterator const & >(( bp::arg("other") )) );
const_iterator_exposer.def( bp::self != bp::self );
{ //::SireBase::ChunkedVector< double, 100 >::const_iterator::operator=
typedef ::SireBase::ChunkedVector< double, 100 >::const_iterator & ( ::SireBase::ChunkedVector< double, 100 >::const_iterator::*assign_function_type )( ::SireBase::ChunkedVector< double, 100 >::const_iterator const & ) ;
assign_function_type assign_function_value( &::SireBase::ChunkedVector< double, 100 >::const_iterator::operator= );
const_iterator_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
const_iterator_exposer.def( bp::self == bp::self );
}
{ //::SireBase::ChunkedVector< double, 100 >::iterator
typedef bp::class_< SireBase::ChunkedVector< double, 100 >::iterator > iterator_exposer_t;
iterator_exposer_t iterator_exposer = iterator_exposer_t( "iterator", bp::init< >() );
bp::scope iterator_scope( iterator_exposer );
iterator_exposer.def( bp::init< SireBase::ChunkedVector< double, 100 >::iterator const & >(( bp::arg("other") )) );
iterator_exposer.def( bp::self != bp::self );
{ //::SireBase::ChunkedVector< double, 100 >::iterator::operator=
typedef ::SireBase::ChunkedVector< double, 100 >::iterator & ( ::SireBase::ChunkedVector< double, 100 >::iterator::*assign_function_type )( ::SireBase::ChunkedVector< double, 100 >::iterator const & ) ;
assign_function_type assign_function_value( &::SireBase::ChunkedVector< double, 100 >::iterator::operator= );
iterator_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
iterator_exposer.def( bp::self == bp::self );
}
ChunkedVector_double__exposer.def( bp::init< int >(( bp::arg("size") )) );
ChunkedVector_double__exposer.def( bp::init< int, double const & >(( bp::arg("size"), bp::arg("value") )) );
ChunkedVector_double__exposer.def( bp::init< SireBase::ChunkedVector< double, 100 > const & >(( bp::arg("other") )) );
{ //::SireBase::ChunkedVector< double, 100 >::append
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef void ( ::SireBase::ChunkedVector< double, 100 >::*append_function_type )( double const & ) ;
append_function_type append_function_value( &::SireBase::ChunkedVector< double, 100 >::append );
ChunkedVector_double__exposer.def(
"append"
, append_function_value
, ( bp::arg("value") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::at
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef double const & ( ::SireBase::ChunkedVector< double, 100 >::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireBase::ChunkedVector< double, 100 >::at );
ChunkedVector_double__exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::ChunkedVector< double, 100 >::begin
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 >::iterator ( ::SireBase::ChunkedVector< double, 100 >::*begin_function_type )( ) ;
begin_function_type begin_function_value( &::SireBase::ChunkedVector< double, 100 >::begin );
ChunkedVector_double__exposer.def(
"begin"
, begin_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::begin
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 >::const_iterator ( ::SireBase::ChunkedVector< double, 100 >::*begin_function_type )( ) const;
begin_function_type begin_function_value( &::SireBase::ChunkedVector< double, 100 >::begin );
ChunkedVector_double__exposer.def(
"begin"
, begin_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::capacity
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef int ( ::SireBase::ChunkedVector< double, 100 >::*capacity_function_type )( ) const;
capacity_function_type capacity_function_value( &::SireBase::ChunkedVector< double, 100 >::capacity );
ChunkedVector_double__exposer.def(
"capacity"
, capacity_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::clear
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef void ( ::SireBase::ChunkedVector< double, 100 >::*clear_function_type )( ) ;
clear_function_type clear_function_value( &::SireBase::ChunkedVector< double, 100 >::clear );
ChunkedVector_double__exposer.def(
"clear"
, clear_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::constBegin
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 >::const_iterator ( ::SireBase::ChunkedVector< double, 100 >::*constBegin_function_type )( ) const;
constBegin_function_type constBegin_function_value( &::SireBase::ChunkedVector< double, 100 >::constBegin );
ChunkedVector_double__exposer.def(
"constBegin"
, constBegin_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::constEnd
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 >::const_iterator ( ::SireBase::ChunkedVector< double, 100 >::*constEnd_function_type )( ) const;
constEnd_function_type constEnd_function_value( &::SireBase::ChunkedVector< double, 100 >::constEnd );
ChunkedVector_double__exposer.def(
"constEnd"
, constEnd_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::count
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef int ( ::SireBase::ChunkedVector< double, 100 >::*count_function_type )( ) const;
count_function_type count_function_value( &::SireBase::ChunkedVector< double, 100 >::count );
ChunkedVector_double__exposer.def(
"count"
, count_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::count
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef int ( ::SireBase::ChunkedVector< double, 100 >::*count_function_type )( double const & ) const;
count_function_type count_function_value( &::SireBase::ChunkedVector< double, 100 >::count );
ChunkedVector_double__exposer.def(
"count"
, count_function_value
, ( bp::arg("value") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::end
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 >::iterator ( ::SireBase::ChunkedVector< double, 100 >::*end_function_type )( ) ;
end_function_type end_function_value( &::SireBase::ChunkedVector< double, 100 >::end );
ChunkedVector_double__exposer.def(
"end"
, end_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::end
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 >::const_iterator ( ::SireBase::ChunkedVector< double, 100 >::*end_function_type )( ) const;
end_function_type end_function_value( &::SireBase::ChunkedVector< double, 100 >::end );
ChunkedVector_double__exposer.def(
"end"
, end_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::fromList
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 > ( *fromList_function_type )( ::QList< double > const & );
fromList_function_type fromList_function_value( &::SireBase::ChunkedVector< double, 100 >::fromList );
ChunkedVector_double__exposer.def(
"fromList"
, fromList_function_value
, ( bp::arg("list") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::fromStdVector
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 > ( *fromStdVector_function_type )( ::std::vector< double > const & );
fromStdVector_function_type fromStdVector_function_value( &::SireBase::ChunkedVector< double, 100 >::fromStdVector );
ChunkedVector_double__exposer.def(
"fromStdVector"
, fromStdVector_function_value
, ( bp::arg("vector") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::fromVector
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 > ( *fromVector_function_type )( ::QVector< double > const & );
fromVector_function_type fromVector_function_value( &::SireBase::ChunkedVector< double, 100 >::fromVector );
ChunkedVector_double__exposer.def(
"fromVector"
, fromVector_function_value
, ( bp::arg("vector") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::isEmpty
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef bool ( ::SireBase::ChunkedVector< double, 100 >::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireBase::ChunkedVector< double, 100 >::isEmpty );
ChunkedVector_double__exposer.def(
"isEmpty"
, isEmpty_function_value );
}
ChunkedVector_double__exposer.def( bp::self != bp::self );
{ //::SireBase::ChunkedVector< double, 100 >::operator=
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::SireBase::ChunkedVector< double, 100 > & ( ::SireBase::ChunkedVector< double, 100 >::*assign_function_type )( ::SireBase::ChunkedVector< double, 100 > const & ) ;
assign_function_type assign_function_value( &::SireBase::ChunkedVector< double, 100 >::operator= );
ChunkedVector_double__exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
ChunkedVector_double__exposer.def( bp::self == bp::self );
{ //::SireBase::ChunkedVector< double, 100 >::operator[]
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef double & ( ::SireBase::ChunkedVector< double, 100 >::*__getitem___function_type )( int ) ;
__getitem___function_type __getitem___function_value( &::SireBase::ChunkedVector< double, 100 >::operator[] );
ChunkedVector_double__exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_non_const_reference >() );
}
{ //::SireBase::ChunkedVector< double, 100 >::operator[]
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef double const & ( ::SireBase::ChunkedVector< double, 100 >::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireBase::ChunkedVector< double, 100 >::operator[] );
ChunkedVector_double__exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy< bp::copy_const_reference >() );
}
{ //::SireBase::ChunkedVector< double, 100 >::remove
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef void ( ::SireBase::ChunkedVector< double, 100 >::*remove_function_type )( int ) ;
remove_function_type remove_function_value( &::SireBase::ChunkedVector< double, 100 >::remove );
ChunkedVector_double__exposer.def(
"remove"
, remove_function_value
, ( bp::arg("i") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::remove
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef void ( ::SireBase::ChunkedVector< double, 100 >::*remove_function_type )( int,int ) ;
remove_function_type remove_function_value( &::SireBase::ChunkedVector< double, 100 >::remove );
ChunkedVector_double__exposer.def(
"remove"
, remove_function_value
, ( bp::arg("i"), bp::arg("count") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::reserve
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef void ( ::SireBase::ChunkedVector< double, 100 >::*reserve_function_type )( int ) ;
reserve_function_type reserve_function_value( &::SireBase::ChunkedVector< double, 100 >::reserve );
ChunkedVector_double__exposer.def(
"reserve"
, reserve_function_value
, ( bp::arg("count") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::resize
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef void ( ::SireBase::ChunkedVector< double, 100 >::*resize_function_type )( int ) ;
resize_function_type resize_function_value( &::SireBase::ChunkedVector< double, 100 >::resize );
ChunkedVector_double__exposer.def(
"resize"
, resize_function_value
, ( bp::arg("count") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::size
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef int ( ::SireBase::ChunkedVector< double, 100 >::*size_function_type )( ) const;
size_function_type size_function_value( &::SireBase::ChunkedVector< double, 100 >::size );
ChunkedVector_double__exposer.def(
"size"
, size_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::squeeze
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef void ( ::SireBase::ChunkedVector< double, 100 >::*squeeze_function_type )( ) ;
squeeze_function_type squeeze_function_value( &::SireBase::ChunkedVector< double, 100 >::squeeze );
ChunkedVector_double__exposer.def(
"squeeze"
, squeeze_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::toList
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::QList< double > ( ::SireBase::ChunkedVector< double, 100 >::*toList_function_type )( ) const;
toList_function_type toList_function_value( &::SireBase::ChunkedVector< double, 100 >::toList );
ChunkedVector_double__exposer.def(
"toList"
, toList_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::toStdVector
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::std::vector< double > ( ::SireBase::ChunkedVector< double, 100 >::*toStdVector_function_type )( ) const;
toStdVector_function_type toStdVector_function_value( &::SireBase::ChunkedVector< double, 100 >::toStdVector );
ChunkedVector_double__exposer.def(
"toStdVector"
, toStdVector_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::toVector
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef ::QVector< double > ( ::SireBase::ChunkedVector< double, 100 >::*toVector_function_type )( ) const;
toVector_function_type toVector_function_value( &::SireBase::ChunkedVector< double, 100 >::toVector );
ChunkedVector_double__exposer.def(
"toVector"
, toVector_function_value );
}
{ //::SireBase::ChunkedVector< double, 100 >::value
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef double ( ::SireBase::ChunkedVector< double, 100 >::*value_function_type )( int ) const;
value_function_type value_function_value( &::SireBase::ChunkedVector< double, 100 >::value );
ChunkedVector_double__exposer.def(
"value"
, value_function_value
, ( bp::arg("i") ) );
}
{ //::SireBase::ChunkedVector< double, 100 >::value
typedef SireBase::ChunkedVector< double, 100 > exported_class_t;
typedef double ( ::SireBase::ChunkedVector< double, 100 >::*value_function_type )( int,double const & ) const;
value_function_type value_function_value( &::SireBase::ChunkedVector< double, 100 >::value );
ChunkedVector_double__exposer.def(
"value"
, value_function_value
, ( bp::arg("i"), bp::arg("default_value") ) );
}
ChunkedVector_double__exposer.staticmethod( "fromList" );
ChunkedVector_double__exposer.staticmethod( "fromStdVector" );
ChunkedVector_double__exposer.staticmethod( "fromVector" );
ChunkedVector_double__exposer.def( "__copy__", &__copy__);
ChunkedVector_double__exposer.def( "__deepcopy__", &__copy__);
ChunkedVector_double__exposer.def( "clone", &__copy__);
ChunkedVector_double__exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireBase::ChunkedVector<double, 100> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
ChunkedVector_double__exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireBase::ChunkedVector<double, 100> >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
ChunkedVector_double__exposer.def( "__str__", &pvt_get_name);
ChunkedVector_double__exposer.def( "__repr__", &pvt_get_name);
ChunkedVector_double__exposer.def( "__len__", &__len_size< ::SireBase::ChunkedVector<double, 100> > );
}
}
void register_Molecules_class(){
{ //::SireMol::Molecules
typedef bp::class_< SireMol::Molecules, bp::bases< SireBase::Property > > Molecules_exposer_t;
Molecules_exposer_t Molecules_exposer = Molecules_exposer_t( "Molecules", bp::init< >() );
bp::scope Molecules_scope( Molecules_exposer );
Molecules_exposer.def( bp::init< SireMol::MoleculeView const & >(( bp::arg("molecule") )) );
Molecules_exposer.def( bp::init< SireMol::ViewsOfMol const & >(( bp::arg("molviews") )) );
Molecules_exposer.def( bp::init< SireMol::Molecules const & >(( bp::arg("other") )) );
{ //::SireMol::Molecules::add
typedef void ( ::SireMol::Molecules::*add_function_type )( ::SireMol::MoleculeView const & ) ;
add_function_type add_function_value( &::SireMol::Molecules::add );
Molecules_exposer.def(
"add"
, add_function_value
, ( bp::arg("molview") ) );
}
{ //::SireMol::Molecules::add
typedef void ( ::SireMol::Molecules::*add_function_type )( ::SireMol::ViewsOfMol const & ) ;
add_function_type add_function_value( &::SireMol::Molecules::add );
Molecules_exposer.def(
"add"
, add_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireMol::Molecules::add
typedef void ( ::SireMol::Molecules::*add_function_type )( ::SireMol::Molecules const & ) ;
add_function_type add_function_value( &::SireMol::Molecules::add );
Molecules_exposer.def(
"add"
, add_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireMol::Molecules::addIfUnique
typedef bool ( ::SireMol::Molecules::*addIfUnique_function_type )( ::SireMol::MoleculeView const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireMol::Molecules::addIfUnique );
Molecules_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molview") ) );
}
{ //::SireMol::Molecules::addIfUnique
typedef ::SireMol::ViewsOfMol ( ::SireMol::Molecules::*addIfUnique_function_type )( ::SireMol::ViewsOfMol const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireMol::Molecules::addIfUnique );
Molecules_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireMol::Molecules::addIfUnique
typedef ::QList< SireMol::ViewsOfMol > ( ::SireMol::Molecules::*addIfUnique_function_type )( ::SireMol::Molecules const & ) ;
addIfUnique_function_type addIfUnique_function_value( &::SireMol::Molecules::addIfUnique );
Molecules_exposer.def(
"addIfUnique"
, addIfUnique_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireMol::Molecules::assertContains
typedef void ( ::SireMol::Molecules::*assertContains_function_type )( ::SireMol::MolNum ) const;
assertContains_function_type assertContains_function_value( &::SireMol::Molecules::assertContains );
Molecules_exposer.def(
"assertContains"
, assertContains_function_value
, ( bp::arg("molnum") ) );
}
{ //::SireMol::Molecules::at
typedef ::SireMol::ViewsOfMol const & ( ::SireMol::Molecules::*at_function_type )( ::SireMol::MolNum ) const;
at_function_type at_function_value( &::SireMol::Molecules::at );
Molecules_exposer.def(
"at"
, at_function_value
, ( bp::arg("molnum") )
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireMol::Molecules::at
typedef ::SireMol::PartialMolecule ( ::SireMol::Molecules::*at_function_type )( ::boost::tuples::tuple< SireMol::MolNum, SireID::Index, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type > const & ) const;
at_function_type at_function_value( &::SireMol::Molecules::at );
Molecules_exposer.def(
"at"
, at_function_value
, ( bp::arg("viewidx") ) );
}
{ //::SireMol::Molecules::at
typedef ::SireMol::PartialMolecule ( ::SireMol::Molecules::*at_function_type )( ::SireMol::MolNum,int ) const;
at_function_type at_function_value( &::SireMol::Molecules::at );
Molecules_exposer.def(
"at"
, at_function_value
, ( bp::arg("molnum"), bp::arg("idx") ) );
}
{ //::SireMol::Molecules::back
typedef ::SireMol::ViewsOfMol const & ( ::SireMol::Molecules::*back_function_type )( ) const;
back_function_type back_function_value( &::SireMol::Molecules::back );
Molecules_exposer.def(
"back"
, back_function_value
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireMol::Molecules::begin
typedef ::SireBase::ChunkedHash< SireMol::MolNum, SireMol::ViewsOfMol, 100 >::const_iterator ( ::SireMol::Molecules::*begin_function_type )( ) const;
begin_function_type begin_function_value( &::SireMol::Molecules::begin );
Molecules_exposer.def(
"begin"
, begin_function_value );
}
{ //::SireMol::Molecules::clear
typedef void ( ::SireMol::Molecules::*clear_function_type )( ) ;
clear_function_type clear_function_value( &::SireMol::Molecules::clear );
Molecules_exposer.def(
"clear"
, clear_function_value );
}
{ //::SireMol::Molecules::constBegin
typedef ::SireBase::ChunkedHash< SireMol::MolNum, SireMol::ViewsOfMol, 100 >::const_iterator ( ::SireMol::Molecules::*constBegin_function_type )( ) const;
constBegin_function_type constBegin_function_value( &::SireMol::Molecules::constBegin );
Molecules_exposer.def(
"constBegin"
, constBegin_function_value );
}
{ //::SireMol::Molecules::constEnd
typedef ::SireBase::ChunkedHash< SireMol::MolNum, SireMol::ViewsOfMol, 100 >::const_iterator ( ::SireMol::Molecules::*constEnd_function_type )( ) const;
constEnd_function_type constEnd_function_value( &::SireMol::Molecules::constEnd );
Molecules_exposer.def(
"constEnd"
, constEnd_function_value );
}
{ //::SireMol::Molecules::constFind
typedef ::SireBase::ChunkedHash< SireMol::MolNum, SireMol::ViewsOfMol, 100 >::const_iterator ( ::SireMol::Molecules::*constFind_function_type )( ::SireMol::MolNum ) const;
constFind_function_type constFind_function_value( &::SireMol::Molecules::constFind );
Molecules_exposer.def(
"constFind"
, constFind_function_value
, ( bp::arg("molnum") ) );
}
{ //::SireMol::Molecules::contains
typedef bool ( ::SireMol::Molecules::*contains_function_type )( ::SireMol::MolNum ) const;
contains_function_type contains_function_value( &::SireMol::Molecules::contains );
Molecules_exposer.def(
"contains"
, contains_function_value
, ( bp::arg("molnum") ) );
}
{ //::SireMol::Molecules::contains
typedef bool ( ::SireMol::Molecules::*contains_function_type )( ::SireMol::MoleculeView const & ) const;
contains_function_type contains_function_value( &::SireMol::Molecules::contains );
Molecules_exposer.def(
"contains"
, contains_function_value
, ( bp::arg("molview") ) );
}
{ //::SireMol::Molecules::contains
typedef bool ( ::SireMol::Molecules::*contains_function_type )( ::SireMol::ViewsOfMol const & ) const;
contains_function_type contains_function_value( &::SireMol::Molecules::contains );
Molecules_exposer.def(
"contains"
, contains_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireMol::Molecules::contains
typedef bool ( ::SireMol::Molecules::*contains_function_type )( ::SireMol::Molecules const & ) const;
contains_function_type contains_function_value( &::SireMol::Molecules::contains );
Molecules_exposer.def(
"contains"
, contains_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireMol::Molecules::count
typedef int ( ::SireMol::Molecules::*count_function_type )( ) const;
count_function_type count_function_value( &::SireMol::Molecules::count );
Molecules_exposer.def(
"count"
, count_function_value );
}
{ //::SireMol::Molecules::end
typedef ::SireBase::ChunkedHash< SireMol::MolNum, SireMol::ViewsOfMol, 100 >::const_iterator ( ::SireMol::Molecules::*end_function_type )( ) const;
end_function_type end_function_value( &::SireMol::Molecules::end );
Molecules_exposer.def(
"end"
, end_function_value );
}
{ //::SireMol::Molecules::find
typedef ::SireBase::ChunkedHash< SireMol::MolNum, SireMol::ViewsOfMol, 100 >::const_iterator ( ::SireMol::Molecules::*find_function_type )( ::SireMol::MolNum ) const;
find_function_type find_function_value( &::SireMol::Molecules::find );
Molecules_exposer.def(
"find"
, find_function_value
, ( bp::arg("molnum") ) );
}
{ //::SireMol::Molecules::first
typedef ::SireMol::ViewsOfMol const & ( ::SireMol::Molecules::*first_function_type )( ) const;
first_function_type first_function_value( &::SireMol::Molecules::first );
Molecules_exposer.def(
"first"
, first_function_value
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireMol::Molecules::front
typedef ::SireMol::ViewsOfMol const & ( ::SireMol::Molecules::*front_function_type )( ) const;
front_function_type front_function_value( &::SireMol::Molecules::front );
Molecules_exposer.def(
"front"
, front_function_value
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireMol::Molecules::intersects
typedef bool ( ::SireMol::Molecules::*intersects_function_type )( ::SireMol::MoleculeView const & ) const;
intersects_function_type intersects_function_value( &::SireMol::Molecules::intersects );
Molecules_exposer.def(
"intersects"
, intersects_function_value
, ( bp::arg("molview") ) );
}
{ //::SireMol::Molecules::intersects
typedef bool ( ::SireMol::Molecules::*intersects_function_type )( ::SireMol::Molecules const & ) const;
intersects_function_type intersects_function_value( &::SireMol::Molecules::intersects );
Molecules_exposer.def(
"intersects"
, intersects_function_value
, ( bp::arg("other") ) );
}
{ //::SireMol::Molecules::isEmpty
typedef bool ( ::SireMol::Molecules::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireMol::Molecules::isEmpty );
Molecules_exposer.def(
"isEmpty"
, isEmpty_function_value );
}
{ //::SireMol::Molecules::last
typedef ::SireMol::ViewsOfMol const & ( ::SireMol::Molecules::*last_function_type )( ) const;
last_function_type last_function_value( &::SireMol::Molecules::last );
Molecules_exposer.def(
"last"
, last_function_value
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireMol::Molecules::molNums
typedef ::QSet< SireMol::MolNum > ( ::SireMol::Molecules::*molNums_function_type )( ) const;
molNums_function_type molNums_function_value( &::SireMol::Molecules::molNums );
Molecules_exposer.def(
"molNums"
, molNums_function_value );
}
{ //::SireMol::Molecules::molecule
typedef ::SireMol::ViewsOfMol const & ( ::SireMol::Molecules::*molecule_function_type )( ::SireMol::MolNum ) const;
molecule_function_type molecule_function_value( &::SireMol::Molecules::molecule );
Molecules_exposer.def(
"molecule"
, molecule_function_value
, ( bp::arg("molnum") )
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireMol::Molecules::nMolecules
typedef int ( ::SireMol::Molecules::*nMolecules_function_type )( ) const;
nMolecules_function_type nMolecules_function_value( &::SireMol::Molecules::nMolecules );
Molecules_exposer.def(
"nMolecules"
, nMolecules_function_value );
}
{ //::SireMol::Molecules::nViews
typedef int ( ::SireMol::Molecules::*nViews_function_type )( ) const;
nViews_function_type nViews_function_value( &::SireMol::Molecules::nViews );
Molecules_exposer.def(
"nViews"
, nViews_function_value );
}
{ //::SireMol::Molecules::nViews
typedef int ( ::SireMol::Molecules::*nViews_function_type )( ::SireMol::MolNum ) const;
nViews_function_type nViews_function_value( &::SireMol::Molecules::nViews );
Molecules_exposer.def(
"nViews"
, nViews_function_value
, ( bp::arg("molnum") ) );
}
Molecules_exposer.def( bp::self != bp::self );
Molecules_exposer.def( bp::self + bp::self );
Molecules_exposer.def( bp::self - bp::self );
{ //::SireMol::Molecules::operator=
typedef ::SireMol::Molecules & ( ::SireMol::Molecules::*assign_function_type )( ::SireMol::Molecules const & ) ;
assign_function_type assign_function_value( &::SireMol::Molecules::operator= );
Molecules_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
Molecules_exposer.def( bp::self == bp::self );
{ //::SireMol::Molecules::operator[]
typedef ::SireMol::ViewsOfMol const & ( ::SireMol::Molecules::*__getitem___function_type )( ::SireMol::MolNum ) const;
__getitem___function_type __getitem___function_value( &::SireMol::Molecules::operator[] );
Molecules_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("molnum") )
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireMol::Molecules::operator[]
typedef ::SireMol::PartialMolecule ( ::SireMol::Molecules::*__getitem___function_type )( ::boost::tuples::tuple< SireMol::MolNum, SireID::Index, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type > const & ) const;
__getitem___function_type __getitem___function_value( &::SireMol::Molecules::operator[] );
Molecules_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("viewidx") ) );
}
{ //::SireMol::Molecules::remove
typedef bool ( ::SireMol::Molecules::*remove_function_type )( ::SireMol::MoleculeView const & ) ;
remove_function_type remove_function_value( &::SireMol::Molecules::remove );
Molecules_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molview") ) );
}
{ //::SireMol::Molecules::remove
typedef ::SireMol::ViewsOfMol ( ::SireMol::Molecules::*remove_function_type )( ::SireMol::ViewsOfMol const & ) ;
remove_function_type remove_function_value( &::SireMol::Molecules::remove );
Molecules_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireMol::Molecules::remove
typedef ::QList< SireMol::ViewsOfMol > ( ::SireMol::Molecules::*remove_function_type )( ::SireMol::Molecules const & ) ;
remove_function_type remove_function_value( &::SireMol::Molecules::remove );
Molecules_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireMol::Molecules::remove
typedef ::SireMol::ViewsOfMol ( ::SireMol::Molecules::*remove_function_type )( ::SireMol::MolNum ) ;
remove_function_type remove_function_value( &::SireMol::Molecules::remove );
Molecules_exposer.def(
"remove"
, remove_function_value
, ( bp::arg("molnum") ) );
}
{ //::SireMol::Molecules::removeAll
typedef bool ( ::SireMol::Molecules::*removeAll_function_type )( ::SireMol::MoleculeView const & ) ;
removeAll_function_type removeAll_function_value( &::SireMol::Molecules::removeAll );
Molecules_exposer.def(
"removeAll"
, removeAll_function_value
, ( bp::arg("molview") ) );
}
{ //::SireMol::Molecules::removeAll
typedef ::SireMol::ViewsOfMol ( ::SireMol::Molecules::*removeAll_function_type )( ::SireMol::ViewsOfMol const & ) ;
removeAll_function_type removeAll_function_value( &::SireMol::Molecules::removeAll );
Molecules_exposer.def(
"removeAll"
, removeAll_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireMol::Molecules::removeAll
typedef ::QList< SireMol::ViewsOfMol > ( ::SireMol::Molecules::*removeAll_function_type )( ::SireMol::Molecules const & ) ;
removeAll_function_type removeAll_function_value( &::SireMol::Molecules::removeAll );
Molecules_exposer.def(
"removeAll"
, removeAll_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireMol::Molecules::removeAll
typedef bool ( ::SireMol::Molecules::*removeAll_function_type )( ) ;
removeAll_function_type removeAll_function_value( &::SireMol::Molecules::removeAll );
Molecules_exposer.def(
"removeAll"
, removeAll_function_value );
}
{ //::SireMol::Molecules::removeDuplicates
typedef bool ( ::SireMol::Molecules::*removeDuplicates_function_type )( ) ;
removeDuplicates_function_type removeDuplicates_function_value( &::SireMol::Molecules::removeDuplicates );
Molecules_exposer.def(
"removeDuplicates"
, removeDuplicates_function_value );
}
{ //::SireMol::Molecules::reserve
typedef void ( ::SireMol::Molecules::*reserve_function_type )( int ) ;
reserve_function_type reserve_function_value( &::SireMol::Molecules::reserve );
Molecules_exposer.def(
"reserve"
, reserve_function_value
, ( bp::arg("nmolecules") ) );
}
{ //::SireMol::Molecules::toString
typedef ::QString ( ::SireMol::Molecules::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireMol::Molecules::toString );
Molecules_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireMol::Molecules::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireMol::Molecules::typeName );
Molecules_exposer.def(
"typeName"
, typeName_function_value );
}
{ //::SireMol::Molecules::unite
typedef bool ( ::SireMol::Molecules::*unite_function_type )( ::SireMol::MoleculeView const & ) ;
unite_function_type unite_function_value( &::SireMol::Molecules::unite );
Molecules_exposer.def(
"unite"
, unite_function_value
, ( bp::arg("molview") ) );
}
{ //::SireMol::Molecules::unite
typedef ::SireMol::ViewsOfMol ( ::SireMol::Molecules::*unite_function_type )( ::SireMol::ViewsOfMol const & ) ;
unite_function_type unite_function_value( &::SireMol::Molecules::unite );
Molecules_exposer.def(
"unite"
, unite_function_value
, ( bp::arg("molviews") ) );
}
{ //::SireMol::Molecules::unite
typedef ::QList< SireMol::ViewsOfMol > ( ::SireMol::Molecules::*unite_function_type )( ::SireMol::Molecules const & ) ;
unite_function_type unite_function_value( &::SireMol::Molecules::unite );
Molecules_exposer.def(
"unite"
, unite_function_value
, ( bp::arg("other") ) );
}
{ //::SireMol::Molecules::uniteViews
typedef bool ( ::SireMol::Molecules::*uniteViews_function_type )( ) ;
uniteViews_function_type uniteViews_function_value( &::SireMol::Molecules::uniteViews );
Molecules_exposer.def(
"uniteViews"
, uniteViews_function_value );
}
{ //::SireMol::Molecules::update
typedef bool ( ::SireMol::Molecules::*update_function_type )( ::SireMol::MoleculeData const & ) ;
update_function_type update_function_value( &::SireMol::Molecules::update );
Molecules_exposer.def(
"update"
, update_function_value
, ( bp::arg("moldata") ) );
}
{ //::SireMol::Molecules::update
typedef bool ( ::SireMol::Molecules::*update_function_type )( ::SireMol::MoleculeView const & ) ;
update_function_type update_function_value( &::SireMol::Molecules::update );
Molecules_exposer.def(
"update"
, update_function_value
, ( bp::arg("molview") ) );
}
{ //::SireMol::Molecules::update
typedef ::QList< SireMol::Molecule > ( ::SireMol::Molecules::*update_function_type )( ::SireMol::Molecules const & ) ;
update_function_type update_function_value( &::SireMol::Molecules::update );
Molecules_exposer.def(
"update"
, update_function_value
, ( bp::arg("molecules") ) );
}
{ //::SireMol::Molecules::what
typedef char const * ( ::SireMol::Molecules::*what_function_type )( ) const;
what_function_type what_function_value( &::SireMol::Molecules::what );
Molecules_exposer.def(
"what"
, what_function_value );
}
Molecules_exposer.staticmethod( "typeName" );
Molecules_exposer.def( "__copy__", &__copy__);
Molecules_exposer.def( "__deepcopy__", &__copy__);
Molecules_exposer.def( "clone", &__copy__);
Molecules_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireMol::Molecules >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Molecules_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireMol::Molecules >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
Molecules_exposer.def( "__str__", &__str__< ::SireMol::Molecules > );
Molecules_exposer.def( "__repr__", &__str__< ::SireMol::Molecules > );
Molecules_exposer.def( "__len__", &__len_count< ::SireMol::Molecules > );
}
}
void register_CombinedSpace_class(){
{ //::SireVol::CombinedSpace
typedef bp::class_< SireVol::CombinedSpace, bp::bases< SireVol::Space, SireBase::Property > > CombinedSpace_exposer_t;
CombinedSpace_exposer_t CombinedSpace_exposer = CombinedSpace_exposer_t( "CombinedSpace", bp::init< >() );
bp::scope CombinedSpace_scope( CombinedSpace_exposer );
CombinedSpace_exposer.def( bp::init< SireVol::Space const & >(( bp::arg("space") )) );
CombinedSpace_exposer.def( bp::init< SireVol::Space const &, SireVol::Space const & >(( bp::arg("space0"), bp::arg("space1") )) );
CombinedSpace_exposer.def( bp::init< QList< SireBase::PropPtr< SireVol::Space > > const & >(( bp::arg("spaces") )) );
CombinedSpace_exposer.def( bp::init< QVector< SireBase::PropPtr< SireVol::Space > > const & >(( bp::arg("spaces") )) );
CombinedSpace_exposer.def( bp::init< SireVol::CombinedSpace const & >(( bp::arg("other") )) );
{ //::SireVol::CombinedSpace::at
typedef ::SireVol::Space const & ( ::SireVol::CombinedSpace::*at_function_type )( int ) const;
at_function_type at_function_value( &::SireVol::CombinedSpace::at );
CombinedSpace_exposer.def(
"at"
, at_function_value
, ( bp::arg("i") )
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireVol::CombinedSpace::beyond
typedef bool ( ::SireVol::CombinedSpace::*beyond_function_type )( double,::SireVol::CoordGroup const &,::SireVol::CoordGroup const & ) const;
beyond_function_type beyond_function_value( &::SireVol::CombinedSpace::beyond );
CombinedSpace_exposer.def(
"beyond"
, beyond_function_value
, ( bp::arg("dist"), bp::arg("group0"), bp::arg("group1") ) );
}
{ //::SireVol::CombinedSpace::beyond
typedef bool ( ::SireVol::CombinedSpace::*beyond_function_type )( double,::SireVol::AABox const &,::SireVol::AABox const & ) const;
beyond_function_type beyond_function_value( &::SireVol::CombinedSpace::beyond );
CombinedSpace_exposer.def(
"beyond"
, beyond_function_value
, ( bp::arg("dist"), bp::arg("aabox0"), bp::arg("aabox1") ) );
}
{ //::SireVol::CombinedSpace::calcAngle
typedef ::SireUnits::Dimension::Angle ( ::SireVol::CombinedSpace::*calcAngle_function_type )( ::SireMaths::Vector const &,::SireMaths::Vector const &,::SireMaths::Vector const & ) const;
calcAngle_function_type calcAngle_function_value( &::SireVol::CombinedSpace::calcAngle );
CombinedSpace_exposer.def(
"calcAngle"
, calcAngle_function_value
, ( bp::arg("point0"), bp::arg("point1"), bp::arg("point2") ) );
}
{ //::SireVol::CombinedSpace::calcDihedral
typedef ::SireUnits::Dimension::Angle ( ::SireVol::CombinedSpace::*calcDihedral_function_type )( ::SireMaths::Vector const &,::SireMaths::Vector const &,::SireMaths::Vector const &,::SireMaths::Vector const & ) const;
calcDihedral_function_type calcDihedral_function_value( &::SireVol::CombinedSpace::calcDihedral );
CombinedSpace_exposer.def(
"calcDihedral"
, calcDihedral_function_value
, ( bp::arg("point0"), bp::arg("point1"), bp::arg("point2"), bp::arg("point3") ) );
}
{ //::SireVol::CombinedSpace::calcDist
typedef double ( ::SireVol::CombinedSpace::*calcDist_function_type )( ::SireMaths::Vector const &,::SireMaths::Vector const & ) const;
calcDist_function_type calcDist_function_value( &::SireVol::CombinedSpace::calcDist );
CombinedSpace_exposer.def(
"calcDist"
, calcDist_function_value
, ( bp::arg("point0"), bp::arg("point1") ) );
}
{ //::SireVol::CombinedSpace::calcDist
typedef double ( ::SireVol::CombinedSpace::*calcDist_function_type )( ::SireVol::CoordGroup const &,::SireVol::DistMatrix & ) const;
calcDist_function_type calcDist_function_value( &::SireVol::CombinedSpace::calcDist );
CombinedSpace_exposer.def(
"calcDist"
, calcDist_function_value
, ( bp::arg("group"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcDist
typedef double ( ::SireVol::CombinedSpace::*calcDist_function_type )( ::SireVol::CoordGroup const &,::SireVol::CoordGroup const &,::SireVol::DistMatrix & ) const;
calcDist_function_type calcDist_function_value( &::SireVol::CombinedSpace::calcDist );
CombinedSpace_exposer.def(
"calcDist"
, calcDist_function_value
, ( bp::arg("group1"), bp::arg("group2"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcDist
typedef double ( ::SireVol::CombinedSpace::*calcDist_function_type )( ::SireVol::CoordGroup const &,::SireMaths::Vector const &,::SireVol::DistMatrix & ) const;
calcDist_function_type calcDist_function_value( &::SireVol::CombinedSpace::calcDist );
CombinedSpace_exposer.def(
"calcDist"
, calcDist_function_value
, ( bp::arg("group"), bp::arg("point"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcDist2
typedef double ( ::SireVol::CombinedSpace::*calcDist2_function_type )( ::SireMaths::Vector const &,::SireMaths::Vector const & ) const;
calcDist2_function_type calcDist2_function_value( &::SireVol::CombinedSpace::calcDist2 );
CombinedSpace_exposer.def(
"calcDist2"
, calcDist2_function_value
, ( bp::arg("point0"), bp::arg("point1") ) );
}
{ //::SireVol::CombinedSpace::calcDist2
typedef double ( ::SireVol::CombinedSpace::*calcDist2_function_type )( ::SireVol::CoordGroup const &,::SireVol::DistMatrix & ) const;
calcDist2_function_type calcDist2_function_value( &::SireVol::CombinedSpace::calcDist2 );
CombinedSpace_exposer.def(
"calcDist2"
, calcDist2_function_value
, ( bp::arg("group"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcDist2
typedef double ( ::SireVol::CombinedSpace::*calcDist2_function_type )( ::SireVol::CoordGroup const &,::SireVol::CoordGroup const &,::SireVol::DistMatrix & ) const;
calcDist2_function_type calcDist2_function_value( &::SireVol::CombinedSpace::calcDist2 );
CombinedSpace_exposer.def(
"calcDist2"
, calcDist2_function_value
, ( bp::arg("group1"), bp::arg("group2"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcDist2
typedef double ( ::SireVol::CombinedSpace::*calcDist2_function_type )( ::SireVol::CoordGroup const &,::SireMaths::Vector const &,::SireVol::DistMatrix & ) const;
calcDist2_function_type calcDist2_function_value( &::SireVol::CombinedSpace::calcDist2 );
CombinedSpace_exposer.def(
"calcDist2"
, calcDist2_function_value
, ( bp::arg("group"), bp::arg("point"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcDistVector
typedef ::SireMaths::DistVector ( ::SireVol::CombinedSpace::*calcDistVector_function_type )( ::SireMaths::Vector const &,::SireMaths::Vector const & ) const;
calcDistVector_function_type calcDistVector_function_value( &::SireVol::CombinedSpace::calcDistVector );
CombinedSpace_exposer.def(
"calcDistVector"
, calcDistVector_function_value
, ( bp::arg("point0"), bp::arg("point1") ) );
}
{ //::SireVol::CombinedSpace::calcDistVectors
typedef double ( ::SireVol::CombinedSpace::*calcDistVectors_function_type )( ::SireVol::CoordGroup const &,::SireVol::DistVectorMatrix & ) const;
calcDistVectors_function_type calcDistVectors_function_value( &::SireVol::CombinedSpace::calcDistVectors );
CombinedSpace_exposer.def(
"calcDistVectors"
, calcDistVectors_function_value
, ( bp::arg("group"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcDistVectors
typedef double ( ::SireVol::CombinedSpace::*calcDistVectors_function_type )( ::SireVol::CoordGroup const &,::SireVol::CoordGroup const &,::SireVol::DistVectorMatrix & ) const;
calcDistVectors_function_type calcDistVectors_function_value( &::SireVol::CombinedSpace::calcDistVectors );
CombinedSpace_exposer.def(
"calcDistVectors"
, calcDistVectors_function_value
, ( bp::arg("group1"), bp::arg("group2"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcDistVectors
typedef double ( ::SireVol::CombinedSpace::*calcDistVectors_function_type )( ::SireVol::CoordGroup const &,::SireMaths::Vector const &,::SireVol::DistVectorMatrix & ) const;
calcDistVectors_function_type calcDistVectors_function_value( &::SireVol::CombinedSpace::calcDistVectors );
CombinedSpace_exposer.def(
"calcDistVectors"
, calcDistVectors_function_value
, ( bp::arg("group"), bp::arg("point"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcInvDist
typedef double ( ::SireVol::CombinedSpace::*calcInvDist_function_type )( ::SireVol::CoordGroup const &,::SireVol::DistMatrix & ) const;
calcInvDist_function_type calcInvDist_function_value( &::SireVol::CombinedSpace::calcInvDist );
CombinedSpace_exposer.def(
"calcInvDist"
, calcInvDist_function_value
, ( bp::arg("group"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcInvDist
typedef double ( ::SireVol::CombinedSpace::*calcInvDist_function_type )( ::SireVol::CoordGroup const &,::SireVol::CoordGroup const &,::SireVol::DistMatrix & ) const;
calcInvDist_function_type calcInvDist_function_value( &::SireVol::CombinedSpace::calcInvDist );
CombinedSpace_exposer.def(
"calcInvDist"
, calcInvDist_function_value
, ( bp::arg("group1"), bp::arg("group2"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcInvDist2
typedef double ( ::SireVol::CombinedSpace::*calcInvDist2_function_type )( ::SireVol::CoordGroup const &,::SireVol::DistMatrix & ) const;
calcInvDist2_function_type calcInvDist2_function_value( &::SireVol::CombinedSpace::calcInvDist2 );
CombinedSpace_exposer.def(
"calcInvDist2"
, calcInvDist2_function_value
, ( bp::arg("group"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::calcInvDist2
typedef double ( ::SireVol::CombinedSpace::*calcInvDist2_function_type )( ::SireVol::CoordGroup const &,::SireVol::CoordGroup const &,::SireVol::DistMatrix & ) const;
calcInvDist2_function_type calcInvDist2_function_value( &::SireVol::CombinedSpace::calcInvDist2 );
CombinedSpace_exposer.def(
"calcInvDist2"
, calcInvDist2_function_value
, ( bp::arg("group1"), bp::arg("group2"), bp::arg("distmat") ) );
}
{ //::SireVol::CombinedSpace::count
typedef int ( ::SireVol::CombinedSpace::*count_function_type )( ) const;
count_function_type count_function_value( &::SireVol::CombinedSpace::count );
CombinedSpace_exposer.def(
"count"
, count_function_value );
}
{ //::SireVol::CombinedSpace::getBoxCenter
typedef ::SireMaths::Vector ( ::SireVol::CombinedSpace::*getBoxCenter_function_type )( ::SireMaths::Vector const & ) const;
getBoxCenter_function_type getBoxCenter_function_value( &::SireVol::CombinedSpace::getBoxCenter );
CombinedSpace_exposer.def(
"getBoxCenter"
, getBoxCenter_function_value
, ( bp::arg("p") ) );
}
{ //::SireVol::CombinedSpace::getBoxCenter
typedef ::SireMaths::Vector ( ::SireVol::CombinedSpace::*getBoxCenter_function_type )( ::SireMaths::Vector const &,::SireMaths::Vector const & ) const;
getBoxCenter_function_type getBoxCenter_function_value( &::SireVol::CombinedSpace::getBoxCenter );
CombinedSpace_exposer.def(
"getBoxCenter"
, getBoxCenter_function_value
, ( bp::arg("p"), bp::arg("center") ) );
}
{ //::SireVol::CombinedSpace::getCopiesWithin
typedef ::QList< boost::tuples::tuple< double, SireVol::CoordGroup, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type, boost::tuples::null_type > > ( ::SireVol::CombinedSpace::*getCopiesWithin_function_type )( ::SireVol::CoordGroup const &,::SireVol::CoordGroup const &,double ) const;
getCopiesWithin_function_type getCopiesWithin_function_value( &::SireVol::CombinedSpace::getCopiesWithin );
CombinedSpace_exposer.def(
"getCopiesWithin"
, getCopiesWithin_function_value
, ( bp::arg("group"), bp::arg("center"), bp::arg("dist") ) );
}
{ //::SireVol::CombinedSpace::getImagesWithin
typedef ::QVector< SireMaths::Vector > ( ::SireVol::CombinedSpace::*getImagesWithin_function_type )( ::SireMaths::Vector const &,::SireMaths::Vector const &,double ) const;
getImagesWithin_function_type getImagesWithin_function_value( &::SireVol::CombinedSpace::getImagesWithin );
CombinedSpace_exposer.def(
"getImagesWithin"
, getImagesWithin_function_value
, ( bp::arg("point"), bp::arg("center"), bp::arg("dist") ) );
}
{ //::SireVol::CombinedSpace::getMinimumImage
typedef ::SireVol::CoordGroup ( ::SireVol::CombinedSpace::*getMinimumImage_function_type )( ::SireVol::CoordGroup const &,::SireMaths::Vector const & ) const;
getMinimumImage_function_type getMinimumImage_function_value( &::SireVol::CombinedSpace::getMinimumImage );
CombinedSpace_exposer.def(
"getMinimumImage"
, getMinimumImage_function_value
, ( bp::arg("group"), bp::arg("center") ) );
}
{ //::SireVol::CombinedSpace::getMinimumImage
typedef ::SireVol::CoordGroupArray ( ::SireVol::CombinedSpace::*getMinimumImage_function_type )( ::SireVol::CoordGroupArray const &,::SireMaths::Vector const &,bool ) const;
getMinimumImage_function_type getMinimumImage_function_value( &::SireVol::CombinedSpace::getMinimumImage );
CombinedSpace_exposer.def(
"getMinimumImage"
, getMinimumImage_function_value
, ( bp::arg("groups"), bp::arg("center"), bp::arg("translate_as_one")=(bool)(false) ) );
}
{ //::SireVol::CombinedSpace::getMinimumImage
typedef ::SireVol::AABox ( ::SireVol::CombinedSpace::*getMinimumImage_function_type )( ::SireVol::AABox const &,::SireMaths::Vector const & ) const;
getMinimumImage_function_type getMinimumImage_function_value( &::SireVol::CombinedSpace::getMinimumImage );
CombinedSpace_exposer.def(
"getMinimumImage"
, getMinimumImage_function_value
, ( bp::arg("aabox"), bp::arg("center") ) );
}
{ //::SireVol::CombinedSpace::getMinimumImage
typedef ::SireMaths::Vector ( ::SireVol::CombinedSpace::*getMinimumImage_function_type )( ::SireMaths::Vector const &,::SireMaths::Vector const & ) const;
getMinimumImage_function_type getMinimumImage_function_value( &::SireVol::CombinedSpace::getMinimumImage );
CombinedSpace_exposer.def(
"getMinimumImage"
, getMinimumImage_function_value
, ( bp::arg("point"), bp::arg("center") ) );
}
{ //::SireVol::CombinedSpace::getRandomPoint
typedef ::SireMaths::Vector ( ::SireVol::CombinedSpace::*getRandomPoint_function_type )( ::SireMaths::Vector const &,::SireMaths::RanGenerator const & ) const;
getRandomPoint_function_type getRandomPoint_function_value( &::SireVol::CombinedSpace::getRandomPoint );
CombinedSpace_exposer.def(
"getRandomPoint"
, getRandomPoint_function_value
, ( bp::arg("center"), bp::arg("generator") ) );
}
{ //::SireVol::CombinedSpace::isCartesian
typedef bool ( ::SireVol::CombinedSpace::*isCartesian_function_type )( ) const;
isCartesian_function_type isCartesian_function_value( &::SireVol::CombinedSpace::isCartesian );
CombinedSpace_exposer.def(
"isCartesian"
, isCartesian_function_value );
}
{ //::SireVol::CombinedSpace::isEmpty
typedef bool ( ::SireVol::CombinedSpace::*isEmpty_function_type )( ) const;
isEmpty_function_type isEmpty_function_value( &::SireVol::CombinedSpace::isEmpty );
CombinedSpace_exposer.def(
"isEmpty"
, isEmpty_function_value );
}
{ //::SireVol::CombinedSpace::isPeriodic
typedef bool ( ::SireVol::CombinedSpace::*isPeriodic_function_type )( ) const;
isPeriodic_function_type isPeriodic_function_value( &::SireVol::CombinedSpace::isPeriodic );
CombinedSpace_exposer.def(
"isPeriodic"
, isPeriodic_function_value );
}
{ //::SireVol::CombinedSpace::minimumDistance
typedef double ( ::SireVol::CombinedSpace::*minimumDistance_function_type )( ::SireVol::AABox const &,::SireVol::AABox const & ) const;
minimumDistance_function_type minimumDistance_function_value( &::SireVol::CombinedSpace::minimumDistance );
CombinedSpace_exposer.def(
"minimumDistance"
, minimumDistance_function_value
, ( bp::arg("box0"), bp::arg("box1") ) );
}
{ //::SireVol::CombinedSpace::minimumDistance
typedef double ( ::SireVol::CombinedSpace::*minimumDistance_function_type )( ::SireVol::CoordGroup const &,::SireVol::CoordGroup const & ) const;
minimumDistance_function_type minimumDistance_function_value( &::SireVol::CombinedSpace::minimumDistance );
CombinedSpace_exposer.def(
"minimumDistance"
, minimumDistance_function_value
, ( bp::arg("group0"), bp::arg("group1") ) );
}
{ //::SireVol::CombinedSpace::minimumDistance
typedef double ( ::SireVol::CombinedSpace::*minimumDistance_function_type )( ::SireVol::CoordGroup const & ) const;
minimumDistance_function_type minimumDistance_function_value( &::SireVol::CombinedSpace::minimumDistance );
CombinedSpace_exposer.def(
"minimumDistance"
, minimumDistance_function_value
, ( bp::arg("group") ) );
}
{ //::SireVol::CombinedSpace::nSpaces
typedef int ( ::SireVol::CombinedSpace::*nSpaces_function_type )( ) const;
nSpaces_function_type nSpaces_function_value( &::SireVol::CombinedSpace::nSpaces );
CombinedSpace_exposer.def(
"nSpaces"
, nSpaces_function_value );
}
CombinedSpace_exposer.def( bp::self != bp::self );
{ //::SireVol::CombinedSpace::operator=
typedef ::SireVol::CombinedSpace & ( ::SireVol::CombinedSpace::*assign_function_type )( ::SireVol::CombinedSpace const & ) ;
assign_function_type assign_function_value( &::SireVol::CombinedSpace::operator= );
CombinedSpace_exposer.def(
"assign"
, assign_function_value
, ( bp::arg("other") )
, bp::return_self< >() );
}
CombinedSpace_exposer.def( bp::self == bp::self );
{ //::SireVol::CombinedSpace::operator[]
typedef ::SireVol::Space const & ( ::SireVol::CombinedSpace::*__getitem___function_type )( int ) const;
__getitem___function_type __getitem___function_value( &::SireVol::CombinedSpace::operator[] );
CombinedSpace_exposer.def(
"__getitem__"
, __getitem___function_value
, ( bp::arg("i") )
, bp::return_value_policy<bp::clone_const_reference>() );
}
{ //::SireVol::CombinedSpace::setVolume
typedef ::SireVol::SpacePtr ( ::SireVol::CombinedSpace::*setVolume_function_type )( ::SireUnits::Dimension::Volume ) const;
setVolume_function_type setVolume_function_value( &::SireVol::CombinedSpace::setVolume );
CombinedSpace_exposer.def(
"setVolume"
, setVolume_function_value
, ( bp::arg("volume") ) );
}
{ //::SireVol::CombinedSpace::size
typedef int ( ::SireVol::CombinedSpace::*size_function_type )( ) ;
size_function_type size_function_value( &::SireVol::CombinedSpace::size );
CombinedSpace_exposer.def(
"size"
, size_function_value );
}
{ //::SireVol::CombinedSpace::toString
typedef ::QString ( ::SireVol::CombinedSpace::*toString_function_type )( ) const;
toString_function_type toString_function_value( &::SireVol::CombinedSpace::toString );
CombinedSpace_exposer.def(
"toString"
, toString_function_value );
}
{ //::SireVol::CombinedSpace::typeName
typedef char const * ( *typeName_function_type )( );
typeName_function_type typeName_function_value( &::SireVol::CombinedSpace::typeName );
CombinedSpace_exposer.def(
"typeName"
, typeName_function_value );
}
{ //::SireVol::CombinedSpace::volume
typedef ::SireUnits::Dimension::Volume ( ::SireVol::CombinedSpace::*volume_function_type )( ) const;
volume_function_type volume_function_value( &::SireVol::CombinedSpace::volume );
CombinedSpace_exposer.def(
"volume"
, volume_function_value );
}
CombinedSpace_exposer.staticmethod( "typeName" );
CombinedSpace_exposer.def( "__copy__", &__copy__);
CombinedSpace_exposer.def( "__deepcopy__", &__copy__);
CombinedSpace_exposer.def( "clone", &__copy__);
CombinedSpace_exposer.def( "__rlshift__", &__rlshift__QDataStream< ::SireVol::CombinedSpace >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
CombinedSpace_exposer.def( "__rrshift__", &__rrshift__QDataStream< ::SireVol::CombinedSpace >,
bp::return_internal_reference<1, bp::with_custodian_and_ward<1,2> >() );
CombinedSpace_exposer.def( "__str__", &__str__< ::SireVol::CombinedSpace > );
CombinedSpace_exposer.def( "__repr__", &__str__< ::SireVol::CombinedSpace > );
CombinedSpace_exposer.def( "__len__", &__len_size< ::SireVol::CombinedSpace > );
}
}
