--- trunk/OOPSE/libmdtools/SimInfo.cpp 2004/05/11 21:14:26 1158 +++ trunk/OOPSE/libmdtools/SimInfo.cpp 2004/05/12 14:30:12 1163 @@ -607,7 +607,8 @@ void getFortranGroupArray(SimInfo* info, vectorgetMass()); + // this is a fraction of the cutoff group's mass, not the mass itself! + mfact.push_back(1.0); groupList.push_back(myAtoms[j]->getIndex() + 1); groupStart.push_back(curIndex++); }