[AMBER] regarding sqm

From: Asfa Ali <asfa.iisc.gmail.com>
Date: Thu, 22 Apr 2010 12:21:32 +0530

Hi,

I wanted to ask why has mopac been replaced by sqm in AmberTools 1.3 ? Is
sqm better than mopac, if so, how? Moreover sqm calculation takes a much
longer time to finish that required by mopac fot the same ligand.

Thanks in advance..

Asfa.
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Received on Thu Apr 22 2010 - 00:00:02 PDT