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root/group/trunk/OOPSE_old/src/mdtools/libmdCode/SimInfo.cpp
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Comparing trunk/OOPSE_old/src/mdtools/libmdCode/SimInfo.cpp (file contents):
Revision 294 by mmeineke, Thu Mar 6 17:04:09 2003 UTC vs.
Revision 348 by mmeineke, Fri Mar 14 21:33:10 2003 UTC

# Line 34 | Line 34 | void SimInfo::refreshSim(){
34  
35    fInfo.rlist = rList;
36    fInfo.rcut = rCut;
37 <  fInfo.rlistsq = rlist * rlist;
38 <  fInfo.rcutsq = rCut * rCut;
39 <  fInfo.rcut6 = fInfo.rcutsq * fInfo.rcutsq * fInfo.rcutsq;
40 <  fInfo.natoms = n_atoms;
41 <  fInfo.usePBC = usePBC;
42 <  strcpy( fInfo.ensemble, ensemble );
43 <  strcpy( fInfo.mixingRule, mixingRule );
37 >  fInfo.SIM_uses_PBC = usePBC;
38  
39    isError = 0;
40    setFsimulation( &fInfo, &isError );

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