| # | Line 66 | Line 66 | namespace oopse { | |
|---|---|---|
| 66 | ||
| 67 | fortranForceOptions.vdw14scale = this->getvdw14scale(); | |
| 68 | fortranForceOptions.electrostatic14scale = this->getelectrostatic14scale(); | |
| 69 | + | fortranForceOptions.GayBerneMu = this->getGayBerneMu(); |
| 70 | + | fortranForceOptions.GayBerneNu = this->getGayBerneNu(); |
| 71 | ||
| 72 | + | |
| 73 | std::string DistanceMix = this->getDistanceMixingRule(); | |
| 74 | toUpper(DistanceMix); | |
| 75 | if(DistanceMix == "ARITHMETIC"){ | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |