| 487 | } |
| 488 | |
| 489 | inline double MBTR::k1GeomAtomicNumber(const int &i, const vector<int> &Z) |
| 490 | { |
| 491 | int atomicNumber = Z[i]; |
| 492 | return atomicNumber; |
| 493 | } |
| 494 | |
| 495 | inline double MBTR::k1WeightUnity(const int &i) |
| 496 | { |
nothing calls this directly
no outgoing calls
no test coverage detected