# | Line 9 | Line 9 | forceField = "TraPPE_Ex"; | |
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9 | ||
10 | ||
11 | initialConfig = "./init_butane.eor"; | |
12 | < | forceField = "TraPPE_Ex"; |
12 | > | forceField = "DUFF"; |
13 | targetTemp = 300.0; | |
14 | ensemble = NVE; | |
15 |
– | Removed lines |
+ | Added lines |
< | Changed lines |
> | Changed lines |