Home
last modified time | relevance | path

Searched refs:allder (Results 1 – 3 of 3) sorted by relevance

/dports/science/plumed/plumed2-2.7.2/src/tools/
H A DBiasRepresentation.cpp191 vector<double> allder(ndim*neighbors.size(),0.0); in pushKernel() local
207 for(int j=0; j<ndim; ++j) { allder[ndim*i+j]=tmpder[j]; tmpder[j]=0.;} in pushKernel()
210 mycomm.Sum(allder); in pushKernel()
213 for(int j=0; j<ndim; ++j) {der[j]=allder[ndim*i+j];} in pushKernel()
/dports/science/plumed/plumed2-2.7.2/src/bias/
H A DPBMetaD.cpp839 vector<double> allder(neighbors.size(),0.0); in addGaussian() local
844 allbias[i]=evaluateGaussian(iarg,xx,hill,&allder[i]); in addGaussian()
847 comm.Sum(allder); in addGaussian()
850 der[0]=allder[i]; in addGaussian()
H A DMetaD.cpp1428 vector<double> allder(ncv*neighbors.size(),0.0); in addGaussian() local
1433 allbias[i]=evaluateGaussian(xx,hill,&allder[ncv*i]); in addGaussian()
1436 comm.Sum(allder); in addGaussian()
1439 for(unsigned j=0; j<ncv; ++j) {der[j]=allder[ncv*i+j];} in addGaussian()