On 26/8/2011, at 11:10 a.m., Hashem Taha wrote:
> I do not have Amber 11, so I am unable to do that.
Hmm OK. If you just do 500 steps of steepest descent, what does the output (restrt) file look like?
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Received on Fri Aug 26 2011 - 08:30:04 PDT