| Revision: | 1410 |
| Committed: | Fri Jul 23 20:31:50 2004 UTC (21 years, 1 month ago) by tim |
| File size: | 361 byte(s) |
| Log Message: | modify 5x5.bass |
| # | User | Rev | Content |
|---|---|---|---|
| 1 | gezelter | 1334 | #include "water.mdl" |
| 2 | #include "lipid.mdl" | ||
| 3 | |||
| 4 | nComponents = 2; | ||
| 5 | component{ | ||
| 6 | type = "simpleLipid_16"; | ||
| 7 | nMol = 25; | ||
| 8 | } | ||
| 9 | |||
| 10 | component{ | ||
| 11 | type = "SSD_water"; | ||
| 12 | nMol = 1386; | ||
| 13 | } | ||
| 14 | |||
| 15 | forceField = "DUFF"; | ||
| 16 | ensemble = NVE; | ||
| 17 | |||
| 18 | tim | 1388 | initialConfig = "5x5.in"; |
| 19 | gezelter | 1334 | |
| 20 | targetTemp = 300; | ||
| 21 | |||
| 22 | tim | 1410 | dt = 2.0; |
| 23 | gezelter | 1334 | runTime = 1000.0; |
| 24 | sampleTime = 100.0; | ||
| 25 | |||
| 26 | tim | 1376 | cutoffRadius = 9.0; |
| 27 | switchingRadius = 7.8; | ||
| 28 | |||
| 29 | gezelter | 1334 | dielectric = 80.0; |