| # | Line 356 | Line 356 | void LJFF::readParams( void ){ | |
|---|---|---|
| 356 | ||
| 357 | AtomType* at = new AtomType(); | |
| 358 | at->setIdent(currentAtomType->ident); | |
| 359 | + | printf ("currentName = %s\n", currentAtomType->name); |
| 360 | at->setName(currentAtomType->name); | |
| 361 | at->setLennardJones(); | |
| 362 | at->complete(); | |
| # | Line 383 | Line 384 | void LJFF::readParams( void ){ | |
| 384 | currentAtomType = currentAtomType->next; | |
| 385 | } | |
| 386 | ||
| 387 | < | entry_plug->useLJ = 1; |
| 387 | > | entry_plug->useLennardJones = 1; |
| 388 | ||
| 389 | #ifdef IS_MPI | |
| 390 | sprintf( checkPointMsg, | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |