| # | Line 78 | Line 78 | void Molecule::initialize( molInit &theInit ){ | |
|---|---|---|
| 78 | curCutoffGroup = nextCutoffGroup(iterCutoff)){ | |
| 79 | ||
| 80 | for(cutoffAtom = curCutoffGroup->beginAtom(iterAtom); cutoffAtom != NULL; | |
| 81 | < | cutoffAtom = curCutoffGroup->beginAtom(iterAtom)){ |
| 81 | > | cutoffAtom = curCutoffGroup->nextAtom(iterAtom)){ |
| 82 | #ifdef IS_MPI | |
| 83 | atomIndex = cutoffAtom->getGlobalIndex(); | |
| 84 | #else | |
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