AMBER Archive (2008)

Subject: AMBER: how to extract energy

From: WANG,YING (wangying_at_ufl.edu)
Date: Fri May 23 2008 - 20:08:13 CDT

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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