LIBSBML_CPP_NAMESPACE_USE
int
main (int argc, char *argv[])
{
if (argc != 2)
{
cout << endl << "Usage: printUnits filename" << endl << endl;
return 1;
}
const char* filename = argv[1];
SBMLDocument* document = readSBML(filename);
if (document->getNumErrors() > 0)
{
cerr << "Encountered the following SBML errors:" << endl;
document->printErrors(cerr);
return 1;
}
Model* model = document->getModel();
if (model == 0)
{
cout << "No model present." << endl;
return 1;
}
unsigned int i,j;
for (i = 0; i < model->getNumSpecies(); i++)
{
Species* s = model->getSpecies(i);
cout << "Species " << i << ": "
<< UnitDefinition::printUnits(s->getDerivedUnitDefinition()) << endl;
}
for (i = 0; i < model->getNumCompartments(); i++)
{
Compartment *c = model->getCompartment(i);
cout << "Compartment " << i << ": "
<< UnitDefinition::printUnits(c->getDerivedUnitDefinition())
<< endl;
}
for (i = 0; i < model->getNumParameters(); i++)
{
Parameter *p = model->getParameter(i);
cout << "Parameter " << i << ": "
<< UnitDefinition::printUnits(p->getDerivedUnitDefinition())
<< endl;
}
for (i = 0; i < model->getNumInitialAssignments(); i++)
{
InitialAssignment *ia = model->getInitialAssignment(i);
cout << "InitialAssignment " << i << ": "
<< UnitDefinition::printUnits(ia->getDerivedUnitDefinition()) << endl;
cout << " undeclared units: ";
cout << (ia->containsUndeclaredUnits() ? "yes\n" : "no\n");
}
for (i = 0; i < model->getNumEvents(); i++)
{
Event *e = model->getEvent(i);
cout << "Event " << i << ": " << endl;
if (e->isSetDelay())
{
cout << "Delay: "
<< UnitDefinition::printUnits(e->getDelay()->getDerivedUnitDefinition()) << endl;
cout << " undeclared units: ";
cout << (e->getDelay()->containsUndeclaredUnits() ? "yes\n" : "no\n");
}
for (j = 0; j < e->getNumEventAssignments(); j++)
{
EventAssignment *ea = e->getEventAssignment(j);
cout << "EventAssignment " << j << ": "
<< UnitDefinition::printUnits(ea->getDerivedUnitDefinition()) << endl;
cout << " undeclared units: ";
cout << (ea->containsUndeclaredUnits() ? "yes\n" : "no\n");
}
}
for (i = 0; i < model->getNumReactions(); i++)
{
Reaction *r = model->getReaction(i);
cout << "Reaction " << i << ": " << endl;
if (r->isSetKineticLaw())
{
cout << "Kinetic Law: "
<< UnitDefinition::printUnits(r->getKineticLaw()->getDerivedUnitDefinition()) << endl;
cout << " undeclared units: ";
cout << (r->getKineticLaw()->containsUndeclaredUnits() ? "yes\n" : "no\n");
}
for (j = 0; j < r->getNumReactants(); j++)
{
SpeciesReference *sr = r->getReactant(j);
if (sr->isSetStoichiometryMath())
{
cout << "Reactant stoichiometryMath" << j << ": "
<< UnitDefinition::printUnits(sr->getStoichiometryMath()->getDerivedUnitDefinition()) << endl;
cout << " undeclared units: ";
cout << (sr->getStoichiometryMath()->containsUndeclaredUnits() ? "yes\n" : "no\n");
}
}
for (j = 0; j < r->getNumProducts(); j++)
{
SpeciesReference *sr = r->getProduct(j);
if (sr->isSetStoichiometryMath())
{
cout << "Product stoichiometryMath" << j << ": "
<< UnitDefinition::printUnits(sr->getStoichiometryMath()->getDerivedUnitDefinition()) << endl;
cout << " undeclared units: ";
cout << (sr->getStoichiometryMath()->containsUndeclaredUnits() ? "yes\n" : "no\n");
}
}
}
for (i = 0; i < model->getNumRules(); i++)
{
Rule *r = model->getRule(i);
cout << "Rule " << i << ": "
<< UnitDefinition::printUnits(r->getDerivedUnitDefinition()) << endl;
cout << " undeclared units: ";
cout << (r->containsUndeclaredUnits() ? "yes\n" : "no\n");
}
delete document;
return 0;
}
/* create MOLECULE */
map< string,Id > SbmlReader::createMolecule( map< string,Id > &idMap )
{
map<string,Id>molMap;
static const Cinfo* moleculeCinfo = initMoleculeCinfo();
static const Finfo* modeFinfo = moleculeCinfo->findFinfo( "mode" );
static const Finfo* nInitFinfo = moleculeCinfo->findFinfo( "nInit" );
static const Cinfo* kincomptCinfo = initKinComptCinfo();
static const Finfo* dimensionFinfo = kincomptCinfo->findFinfo( "numDimensions" );
static const Finfo* sizeFinfo = kincomptCinfo->findFinfo( "size" );
int num_species = model_->getNumSpecies();
//cout << "num species: " << num_species << endl;
for ( int sindex = 0; sindex < num_species; sindex++ )
{
Species* s = model_->getSpecies(sindex);
if (!s){
//cout << "species " << sindex << " is nul" << endl;
continue;
}
std::string compt = "";
if ( s->isSetCompartment() )
compt = s->getCompartment();
if (compt.length()< 1){
cout << "compt is empty for species "<< sindex << endl;
continue;
}
string id = s->getId();
//cout<<"species is :"<<id<<endl;
if (id.length() < 1){
continue;
}
/*std::string name = "";
if ( s->isSetName() ){
name = s->getName();
}*/
Id comptEl = idMap[compt];
molecule_ = Neutral::create( "Molecule",id,comptEl,Id::scratchId() );//create Molecule
molMap[id] = comptEl;
elmtMap_[id] = Eref( molecule_ );
//printNotes(s);
UnitDefinition * ud = s->getDerivedUnitDefinition();
assert(ud != NULL);
/*string udef = UnitDefinition::printUnits(ud);
//cout << "species unit :" << udef << endl;*/
double initvalue =0.0;
if ( s->isSetInitialConcentration() )
initvalue = s->getInitialConcentration();
else if ( s->isSetInitialAmount() )
initvalue = s->getInitialAmount() ;
else {
cout << "Invalid SBML: Either initialConcentration or initialAmount must be set." << endl;
return molMap;
}
double transvalue = transformUnits(1,ud);
//cout << "initAmount: " << initvalue << endl;
transvalue *= initvalue;
//cout << "transvalue: " << transvalue << endl;
unsigned int dimension;
get< unsigned int >( comptEl.eref(), dimensionFinfo,dimension );
bool initconc = s->isSetInitialConcentration();
if ( dimension > 0 && initconc) {
double size;
get< double > (comptEl.eref(),sizeFinfo,size);
transvalue *= size;
}
::set< double >( molecule_, nInitFinfo, transvalue ); //initialAmount
bool cons=s->getConstant();
bool bcondition = s->getBoundaryCondition();
if (cons){
::set< int >( molecule_,modeFinfo,4 );
//cout << "set constant 4" << endl;
}else if (bcondition) {
::set< int >( molecule_,modeFinfo,1 );
//cout << "set constant 1" << endl;
}else {
::set< int >( molecule_,modeFinfo,0 );
//cout << "set constant 0" << endl;
}
}
return molMap;
}
/* create MOLECULE */
const SbmlReader::sbmlStr_mooseId SbmlReader::createMolecule( map< string,Id > &comptSidMIdMap) {
Shell* shell = reinterpret_cast< Shell* >( Id().eref().data() );
map< string, Id >molSidcmptMIdMap;
double transvalue = 0.0;
int num_species = model_->getNumSpecies();
if (num_species == 0) {
baseId = Id();
errorFlag_ = true;
return molSidcmptMIdMap;
}
for ( int sindex = 0; sindex < num_species; sindex++ ) {
Species* spe = model_->getSpecies(sindex);
if (!spe) {
continue;
}
std::string compt = "";
if ( spe->isSetCompartment() ) {
compt = spe->getCompartment();
}
if (compt.length()< 1) {
//cout << "compt is empty for species "<< sindex << endl;
continue;
}
string id = spe->getId();
if (id.length() < 1) {
continue;
}
std::string name = "";
if ( spe->isSetName() ) {
name = spe->getName();
name = nameString(name);
}
if (name.empty())
name = id;
double initvalue =0.0;
if ( spe->isSetInitialConcentration() )
initvalue = spe->getInitialConcentration();
else if ( spe->isSetInitialAmount() )
initvalue = spe->getInitialAmount() ;
else {
unsigned int nr = model_->getNumRules();
bool found = false;
for ( unsigned int r = 0; r < nr; r++ ) {
Rule * rule = model_->getRule(r);
bool assignRule = rule->isAssignment();
if ( assignRule ) {
string rule_variable = rule->getVariable();
if (rule_variable.compare(id) == 0) {
found = true;
break;
}
}
}
if (found == false) {
cout << "Invalid SBML: Either initialConcentration or initialAmount must be set or it should be found in assignmentRule but non happening for " << spe->getName() <<endl;
return molSidcmptMIdMap;
}
}
Id comptEl = comptSidMIdMap[compt];
Id meshEntry = Neutral::child( comptEl.eref(), "mesh" );
bool constant = spe->getConstant();
bool boundaryCondition = spe->getBoundaryCondition();
if (boundaryCondition == true)
cout << "Pools having BoundaryCondition true " << name <<endl;
Id pool;
//If constant is true then its equivalent to BuffPool in moose
if (constant == true)
//if( (boundaryCondition == true) && (constant==false))
pool = shell->doCreate("BufPool",comptEl,name,1);
else
pool = shell->doCreate("Pool", comptEl, name ,1);
molSidcmptMIdMap[id] = comptEl;
//Map to Molecule SBML id to Moose Id
molSidMIdMap_[id] = pool;
//shell->doAddMsg( "OneToOne",pool, "mesh", meshEntry, "mesh" );
bool bcondition = spe->getBoundaryCondition();
if ( constant == true && bcondition == false)
cout <<"The species "<< name << " should not appear in reactant or product as per sbml Rules"<< endl;
unsigned int spatialDimen =Field< unsigned int >::get( comptEl, "numDimensions");
UnitDefinition * ud = spe->getDerivedUnitDefinition();
assert(ud != NULL);
bool hasonlySubUnit = spe->getHasOnlySubstanceUnits();
//double v = Field< double >::get( comptEl.path(), "volume" );
transvalue = transformUnits(1,ud,"substance",hasonlySubUnit);
if (hasonlySubUnit) {
// In Moose, no. of molecules (nInit) and unit is "item"
if (spatialDimen > 0 && spe->isSetInitialAmount() ) {
//transvalue *= initvalue;
initvalue *=transvalue;
Field < double> :: set( pool, "nInit", initvalue);
}
} else {
//transvalue *=initvalue;
initvalue *=transvalue;
Field <double> :: set(pool, "concInit",initvalue);
}
//cout << " poolMap_ "<< name << " " <<transvalue << " "<< hasonlySubUnit;
//poolMap_.insert(make_pair(id,make_tuple(name,transvalue,hasonlySubUnit)));
}
return molSidcmptMIdMap;
}
