Searched refs:doInt_ (Results 1 – 4 of 4) sorted by relevance
| /dports/science/plumed/plumed2-2.7.2/src/tools/ |
| H A D | BiasRepresentation.cpp | 39 doInt_=false; in BiasRepresentation()
50 doInt_=false; in BiasRepresentation()
65 doInt_=doInt; in BiasRepresentation()
75 doInt_=false; in BiasRepresentation()
165 …if(doInt_&&(kk->getCenter()[0]+kk->getContinuousSupport()[0] > uppI_ || kk->getCenter()[0]-kk->get… in pushKernel()
179 if(doInt_) bias=kk->evaluate(values,der,true,doInt_,lowI_,uppI_); in pushKernel()
198 if(doInt_) allbias[i]=kk->evaluate(values,der,true,doInt_,lowI_,uppI_); in pushKernel()
|
| H A D | BiasRepresentation.h | 92 bool doInt_; variable
|
| /dports/science/plumed/plumed2-2.7.2/src/bias/ |
| H A D | PBMetaD.cpp | 260 vector<bool> doInt_; member in PLMD::bias::PBMetaD
511 doInt_.resize(getNumberOfArguments(),false); in PBMetaD()
521 else doInt_[i]=true; in PBMetaD()
576 for(unsigned i=0; i<doInt_.size(); i++) { in PBMetaD()
577 …if(doInt_[i]) log.printf(" Upper and Lower limits boundaries for the bias of CV %u are activated\… in PBMetaD()
732 if(doInt_[i]) { in PBMetaD()
768 if(doInt_[0]) log<<plumed.cite( in PBMetaD()
868 if(doInt_[iarg]) { in getGaussianSupport()
917 if(doInt_[iarg]) { in evaluateGaussian()
|
| H A D | MetaD.cpp | 451 bool doInt_; member in PLMD::bias::MetaD
584 uppI_(-1), lowI_(-1), doInt_(false), in MetaD()
822 doInt_=true; in MetaD()
927 …if(doInt_) log.printf(" Upper and Lower limits boundaries for the bias are activated at %f - %f\n… in MetaD()
1254 if(doInt_) { in MetaD()
1285 if(doInt_) log<<plumed.cite( in MetaD()
1483 if(doInt_) { in getGaussianSupport()
1565 if(doInt_) { in evaluateGaussian()
1622 if(doInt_ && der) { in evaluateGaussian()
|