| # | Line 13 | Line 13 | cutoffRadius = 9.0; | |
|---|---|---|
| 13 | targetTemp = 178.5; | |
| 14 | tauThermostat = 1e3; | |
| 15 | cutoffRadius = 9.0; | |
| 16 | – | switchingRadius = 9.0; |
| 16 | cutoffMethod = "SHIFTED_FORCE"; | |
| 17 | skinThickness = 1.0; | |
| 18 | ||
| 19 | ensemble = "NVE"; | |
| 20 | dt = 1.0; | |
| 21 | < | runTime = 1000; |
| 21 | > | runTime = 10000; |
| 22 | ||
| 23 | < | sampleTime = 50000; |
| 23 | > | sampleTime = 500; |
| 24 | statusTime = 10; | |
| 25 | ||
| 26 | thermalTime = 1000.0; | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |