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root/group/trunk/OOPSE/libmdtools/ForceFields.cpp
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Comparing:
branches/mmeineke/OOPSE/libmdtools/ForceFields.cpp (file contents), Revision 377 by mmeineke, Fri Mar 21 17:42:12 2003 UTC vs.
trunk/OOPSE/libmdtools/ForceFields.cpp (file contents), Revision 393 by mmeineke, Mon Mar 24 18:33:51 2003 UTC

# Line 31 | Line 31 | void ForceFields::doForces( int calcPot, int calcStres
31      entry_plug->atoms[i]->zeroForces();
32    }
33  
34 +  for(i=0; i<entry_plug->n_SRI; i++ ){
35 +    entry_plug->sr_interactions[i]->calc_forces();
36 +  }
37 +
38    frc = Atom::getFrcArray();
39    pos = Atom::getPosArray();
40    trq = Atom::getTrqArray();
# Line 41 | Line 45 | void ForceFields::doForces( int calcPot, int calcStres
45      
46    isError = 0;
47    entry_plug->lrPot = 0.0;
48 +
49 +  
50    fortranForceLoop( pos,
51                      A,
52                      u_l,

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