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root/group/trunk/OOPSE-4/src/types/MoleculeStamp.cpp
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Comparing trunk/OOPSE-4/src/types/MoleculeStamp.cpp (file contents):
Revision 2485 by tim, Mon Dec 5 19:10:58 2005 UTC vs.
Revision 2493 by tim, Tue Dec 6 21:01:08 2005 UTC

# Line 360 | Line 360 | void MoleculeStamp::checkTorsions() {
360  
361  
362   void MoleculeStamp::checkTorsions() {
363 <    for(int i = 0; i < getNBends(); ++i) {
363 >    for(int i = 0; i < getNTorsions(); ++i) {
364          TorsionStamp* torsionStamp = getTorsionStamp(i);
365          std::vector<int> torsionAtoms =  torsionStamp ->getMembers();
366          std::vector<int>::iterator j =std::find_if(torsionAtoms.begin(), torsionAtoms.end(), std::bind2nd(std::greater<int>(), getNAtoms()-1));

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