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root/group/branches/new_design/OOPSE-2.0/src/primitives/Molecule.hpp
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Comparing branches/new_design/OOPSE-2.0/src/primitives/Molecule.hpp (file contents):
Revision 1733 by tim, Fri Nov 12 06:19:04 2004 UTC vs.
Revision 1738 by tim, Sat Nov 13 05:08:12 2004 UTC

# Line 233 | Line 233 | class Molecule {
233  
234          Constraint* nextConstraint(std::vector<Constraint*>::iterator& i);
235          
236        //void setStampID( int info ) {stampID = info;}
236  
238        void calcForces( void );
239
240        void atoms2rigidBodies( void );
241
237          /** return the total potential energy of short range interaction of this molecule */
238          double getPotential();
239  

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