--- trunk/OOPSE/libmdtools/Molecule.hpp 2003/03/28 19:33:37 435 +++ trunk/OOPSE/libmdtools/Molecule.hpp 2003/03/31 21:50:59 438 @@ -33,6 +33,8 @@ class Molecule{ (public) ~Molecule( void ); void initialize( molInit &theInit ); + + void setMyIndex( int theIndex ){ myIndex = theIndex;} int getNAtoms ( void ) {return nAtoms;} int getNBonds ( void ) {return nBonds;} @@ -68,6 +70,8 @@ class Molecule{ (public) int nMembers; // .. . . . . . .atoms (legacy code) . . . int nExcludes; // . . . . .. .. excludes .. . . + int myIndex; // mostly just for debug + Atom** myAtoms; // the array of atoms Bond** myBonds; // arrays of all the short range interactions Bend** myBends;