BOOL COrnament::PositionChanged(CPropertyState* pState) const
{
COrnamentState* pCurrent = CurrentState();
COrnamentState* pCompare = StateType(pState);
if (!PropertySet(pState))
{
return FALSE;
}
return
(pState == NULL)
|| (pCurrent->m_cpPosition != pCompare->m_cpPosition);
}
BOOL COrnament::SizeChanged(CPropertyState* pState) const
{
COrnamentState* pCurrent = CurrentState();
COrnamentState* pCompare = StateType(pState);
if (!PropertySet(pState))
{
return FALSE;
}
return
(pState == NULL)
|| (pCurrent->m_dwStyle != pCompare->m_dwStyle)
|| (pCurrent->m_czExtent != pCompare->m_czExtent);
}
void StateWidget::AcceptState()
{
if(edited==NULL)
{
emit reportError(QString("Please, select a state to edit, edit it and then press OK."));
return;
}
if ( !StateNameOK())
{
return;
}
BaseState * toInsertState = StateWidgets[tmpWidget]->getStateObject();
if(toInsertState==NULL)
return;
toInsertState->setName(this->stateNameEdit->text());
toInsertState->setType(StateType(stateTypeCombo->currentIndex()));
toInsertState->setParameters(paramEdit->text());
OKButton->setDisabled(true);
BaseState * tmp = edited;
edited = NULL;
emit ReplaceState(tmp, toInsertState);
}
Analysis::RetType Analysis_State::Setup(ArgList& analyzeArgs, DataSetList* datasetlist, DataFileList* DFLin, int debugIn)
{
debug_ = debugIn;
masterDSL_ = datasetlist;
DataFile* outfile = DFLin->AddDataFile( analyzeArgs.GetStringKey("out"), analyzeArgs );
curveOut_ = DFLin->AddDataFile( analyzeArgs.GetStringKey("curveout"), analyzeArgs );
stateOut_ = DFLin->AddCpptrajFile( analyzeArgs.GetStringKey("stateout"), "State Output",
DataFileList::TEXT, true);
transOut_ = DFLin->AddCpptrajFile( analyzeArgs.GetStringKey("transout"), "Transitions Output",
DataFileList::TEXT, true);
normalize_ = analyzeArgs.hasKey("norm");
// Get definitions of states if present.
// Define states as 'state <#>,<dataset>,<min>,<max>'
std::string state_arg = analyzeArgs.GetStringKey("state");
if (!state_arg.empty()) {
while (!state_arg.empty()) {
// Expect form <#>,<dataset>
ArgList argtmp(state_arg, ",");
if (argtmp.Nargs() != 4) {
mprinterr("Error: Malformed state argument '%s': expect <ID>,<dataset>,<min>,<max>\n",
state_arg.c_str());
return Analysis::ERR;
}
std::string state_id = argtmp.GetStringNext();
// TODO: Check duplicate names
if (state_id.empty()) {
mprinterr("Error: In state argument, could not get ID.\n");
return Analysis::ERR;
}
DataSet* ds = datasetlist->GetDataSet( argtmp.GetStringNext() );
if (ds == 0) return Analysis::ERR;
if (ds->Ndim() != 1) {
mprinterr("Error: Only 1D data sets allowed.\n");
return Analysis::ERR;
}
double min = argtmp.getNextDouble(0.0);
double max = argtmp.getNextDouble(0.0);
if (max < min) {
mprinterr("Error: max value cannot be less than min.\n");
return Analysis::ERR;
}
States_.push_back( StateType(state_id, (DataSet_1D*)ds, min, max) );
state_arg = analyzeArgs.GetStringKey("state");
}
}
if (States_.empty()) {
mprinterr("Error: No states defined.\n");
return Analysis::ERR;
}
state_data_ = datasetlist->AddSet(DataSet::INTEGER, analyzeArgs.GetStringKey("name"), "State");
if (state_data_ == 0) return Analysis::ERR;
if (outfile != 0) outfile->AddDataSet( state_data_ );
mprintf(" STATE: The following states have been set up:\n");
for (StateArray::const_iterator state = States_.begin(); state != States_.end(); ++state)
mprintf("\t%u: %20s %12.4f <= %-20s < %12.4f\n", state - States_.begin(), state->DS().legend(),
state->Min(), state->id(), state->Max());
mprintf("\tState data set: %s\n", state_data_->legend());
if (outfile != 0)
mprintf("\tStates vs time output to file '%s'\n", outfile->DataFilename().full());
if (curveOut_ != 0)
mprintf("\tCurves output to file '%s'\n", curveOut_->DataFilename().full());
mprintf("\tState output to file '%s'\n", stateOut_->Filename().full());
mprintf("\tTransitions output to file '%s'\n", transOut_->Filename().full());
if (normalize_)
mprintf("\tCurves will be normalized to 1.0\n");
return Analysis::OK;
}
