| # | Line 47 | Line 47 | namespace OpenMD { | |
|---|---|---|
| 47 | #endif | |
| 48 | ||
| 49 | namespace OpenMD { | |
| 50 | < | |
| 50 | > | |
| 51 | DistanceFinder::DistanceFinder(SimInfo* info) : info_(info) { | |
| 52 | < | |
| 52 | > | |
| 53 | nStuntDoubles_ = info_->getNGlobalAtoms() + info_->getNGlobalRigidBodies(); | |
| 54 | stuntdoubles_.resize(nStuntDoubles_); | |
| 55 | ||
| # | Line 59 | Line 59 | namespace OpenMD { | |
| 59 | Atom* atom; | |
| 60 | Molecule::RigidBodyIterator rbIter; | |
| 61 | RigidBody* rb; | |
| 62 | – | |
| 62 | ||
| 63 | + | |
| 64 | for (mol = info_->beginMolecule(mi); mol != NULL; | |
| 65 | mol = info_->nextMolecule(mi)) { | |
| 66 | ||
| # | Line 135 | Line 135 | namespace OpenMD { | |
| 135 | } | |
| 136 | } | |
| 137 | } | |
| 138 | – | |
| 138 | return bsResult; | |
| 139 | } | |
| 141 | – | |
| 140 | } | |
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| + | Added lines |
| < | Changed lines |
| > | Changed lines |