# | Line 9 | Line 9 | forceField = "WATER"; | |
---|---|---|
9 | initialConfig = "./ssde.in"; | |
10 | ||
11 | ensemble = NVE; | |
12 | < | forceField = "WATER"; |
13 | < | useReactionField = "false"; |
12 | > | forceField = "DUFF"; |
13 | > | electrostaticSummationMethod = "none" |
14 | dielectric = 80.0; | |
15 | cutoffRadius = 9.0; | |
16 | switchingRadius = 7.7; |
– | Removed lines |
+ | Added lines |
< | Changed lines |
> | Changed lines |