--- trunk/OOPSE/libmdtools/SimInfo.cpp 2004/04/22 21:33:55 1131 +++ trunk/OOPSE/libmdtools/SimInfo.cpp 2004/04/28 22:06:29 1139 @@ -63,6 +63,7 @@ SimInfo::SimInfo(){ useReactionField = 0; useGB = 0; useEAM = 0; + useMolecularCutoffs = 0; excludes = Exclude::Instance(); @@ -436,6 +437,7 @@ void SimInfo::refreshSim(){ //fInfo.SIM_uses_RF = 0; fInfo.SIM_uses_GB = useGB; fInfo.SIM_uses_EAM = useEAM; + fInfo.SIM_uses_molecular_cutoffs = useMolecularCutoffs; n_exclude = excludes->getSize(); excl = excludes->getFortranArray();