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AMBER Archive (2004)Subject: Re: AMBER: the energy difference between sander and nmode
From: David A. Case (case_at_scripps.edu)
On Fri, Nov 12, 2004, xiaowei li wrote:
> I have used SANDER (amber 8) and NMODE (amber 7) to minimize the
It is certainly possible that you have converged to two different local minima
(Why are you using scee=2.0? This is only appropriate for very old force
...good luck...dac
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