Hi, Dear ambers,
My system contain some molecules. The mdout give me the total
energy of the whole system. if I want to know the energy of one of
the molecules but not the total energy of the whole system, how
can I do?
If you know how to do could you tell me? Thanks a lot!!
Ying
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Received on Sun May 25 2008 - 06:08:02 PDT
