| # | Line 17 | Line 17 | useRNEMD = true; | |
|---|---|---|
| 17 | ||
| 18 | ensemble = "NVE"; | |
| 19 | useRNEMD = true; | |
| 20 | < | RNEMD_swapTime = 50; |
| 20 | > | RNEMD_exchangeTime = 50; |
| 21 | RNEMD_objectSelection = "select Ar"; | |
| 22 | + | RNEMD_exchangeType = "KineticScale"; |
| 23 | + | RNEMD_nBins = 10; |
| 24 | + | RNEMD_targetFlux = 1e-3; |
| 25 | dt = 1.0; | |
| 26 | runTime = 1e4; | |
| 27 | ||
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |