Searched refs:vfict_laststep (Results 1 – 3 of 3) sorted by path
119 std::vector<double> vfict_laststep; member in PLMD::bias::ExtendedLagrangian158 vfict_laststep(getNumberOfArguments(),0.0), in ExtendedLagrangian()242 vfictValue[i]->set(vfict_laststep[i]); in calculate()261 vfict_laststep[i]=vfict[i]; in update()
188 vector<double> vfict_laststep; member in PLMD::drr::DynamicReferenceRestraining334 vfict_laststep(getNumberOfArguments(), 0.0), in DynamicReferenceRestraining()758 vfictValue[i]->set(vfict_laststep[i]); in calculate()805 vfict_laststep[i] = vfict[i]; in update()831 oa << step << fict << vfict << vfict_laststep << ffict << ABFGrid in save()849 ia >> step >> fict >> vfict >> vfict_laststep >> ffict >> ABFGrid >> in load()
140 vector<double> vfict_laststep; in extractdrr() local144 ia >> step >> fict >> vfict >> vfict_laststep >> ffict >> abfgrid >> in extractdrr()157 << " Velocity(laststep): " << vfict_laststep[i] << '\n' in extractdrr()189 vector<double> vfict_laststep; in mergewindows() local193 ia >> step >> fict >> vfict >> vfict_laststep >> ffict >> abfgrid >> in mergewindows()233 vector<double> vfict_laststep; in calcDivergence() local237 ia >> step >> fict >> vfict >> vfict_laststep >> ffict >> abfgrid >> in calcDivergence()250 << " Velocity(laststep): " << vfict_laststep[i] << '\n' in calcDivergence()