/home/eoseret/qaas/qaas_runs/178-539-6385/intel/CoMD/build/CoMD/CoMD/src-openmp/ljForce.c: 173 - 191
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173:    for (int iBox=0; iBox<s->boxes->nLocalBoxes; iBox++)
174:    {
175:       int nIBox = s->boxes->nAtoms[iBox];
176:    
177:       // loop over neighbors of iBox
178:       for (int jTmp=0; jTmp<nNbrBoxes; jTmp++)
179:       {
180:          int jBox = s->boxes->nbrBoxes[iBox][jTmp];
181:          
182:          assert(jBox>=0);
183:          
184:          int nJBox = s->boxes->nAtoms[jBox];
185:          
186:          // loop over atoms in iBox
187:          for (int iOff=MAXATOMS*iBox; iOff<(iBox*MAXATOMS+nIBox); iOff++)
188:          {
189: 
190:             // loop over atoms in jBox
191:             for (int jOff=jBox*MAXATOMS; jOff<(jBox*MAXATOMS+nJBox); jOff++)
