Searched refs:old_xyz (Results 1 – 1 of 1) sorted by relevance
| /dports/science/openbabel/openbabel-3.1.1/src/ |
| H A D | forcefield.cpp | 2340 vector3 old_xyz, orig_xyz, xyz_k, dir(0.0, 0.0, 0.0); in LineSearch() local
2359 old_xyz = atom->GetVector(); in LineSearch()
2373 atom->SetVector(old_xyz); in LineSearch()
2589 vector3 old_xyz, orig_xyz, xyz_k, dir(0.0, 0.0, 0.0); in ValidateLineSearch() local
2598 old_xyz = atom->GetVector(); in ValidateLineSearch()
2610 atom->SetVector(old_xyz); in ValidateLineSearch()
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