--- trunk/OOPSE/libmdtools/Molecule.hpp 2003/04/11 15:16:59 490 +++ trunk/OOPSE/libmdtools/Molecule.hpp 2003/07/31 15:35:07 658 @@ -68,6 +68,8 @@ class Molecule{ (public) void getCOM( double COM[3] ); void moveCOM( double delta[3] ); double getCOMvel( double COMvel[3] ); + + double getTotalMass(); private: