# | Line 51 | Line 51 | void SimInfo::refreshSim(){ | |
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51 | fInfo.dielect = dielectric; | |
52 | ||
53 | fInfo.SIM_uses_PBC = usePBC; | |
54 | < | // fInfo.SIM_uses_LJ = useLJ; |
55 | < | fInfo.SIM_uses_LJ = 0; |
54 | > | fInfo.SIM_uses_LJ = useLJ; |
55 | > | |
56 | //fInfo.SIM_uses_sticky = useSticky; | |
57 | fInfo.SIM_uses_sticky = 0; | |
58 | fInfo.SIM_uses_dipoles = useDipole; | |
# | Line 65 | Line 65 | void SimInfo::refreshSim(){ | |
65 | ||
66 | isError = 0; | |
67 | ||
68 | < | fInfo; |
69 | < | n_atoms; |
70 | < | identArray; |
71 | < | n_exclude; |
72 | < | excludes; |
73 | < | nGlobalExcludes; |
74 | < | globalExcludes; |
75 | < | isError; |
68 | > | // fInfo; |
69 | > | // n_atoms; |
70 | > | // identArray; |
71 | > | // n_exclude; |
72 | > | // excludes; |
73 | > | // nGlobalExcludes; |
74 | > | // globalExcludes; |
75 | > | // isError; |
76 | ||
77 | setFsimulation( &fInfo, &n_atoms, identArray, &n_exclude, excl, | |
78 | &nGlobalExcludes, globalExcludes, &isError ); |
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