AMBER: nmode

From: Wei Chen <gtg553p.mail.gatech.edu>
Date: Thu, 4 Aug 2005 14:04:17 -0400

Hi, Guys,

I have a big system about 10,000 atoms. I want to use mm_pbsa to calculate
free energy. But I have no enough memory for entropy calculation by nmode.

Does anybody have ideas to calculate entropy in different ways?

Thanks!

Wei Chen

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Received on Thu Aug 04 2005 - 19:53:00 PDT