[gmx-users] g_fg2cg
dina dusti
dinadusti at yahoo.com
Wed Mar 7 07:54:28 CET 2012
Dear XAvier
Thank you very much from your response.
Yes, I defined mapping in atomistic topology as:
[mapping ]
1 1 2 3 4 5 6
because for butanole we have one bead.
Please help me.
Best Regards
Dina
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