On Tue, Apr 10, 2012, steinbrt.rci.rutgers.edu wrote:
>
> In Amber, unless specifically stated otherwise, units of the output files
> are kcal/mol. I'm not sure if this is stated clearly enough in the manual,
> as you are not the first user to post this question.
Indeed, it is a frequently asked question, with responses in the FAQ
section on our web site. A Google search for "amber units" will get
answers pretty easily -- the second hit from Google is probably the most
useful one.
....dac
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Received on Tue Apr 10 2012 - 10:30:05 PDT
