Re: [AMBER] QMMM and Thermodynamic integration

From: Bill Ross <ross.cgl.ucsf.EDU>
Date: Mon, 17 May 2010 10:05:19 -0700

> Density = 0.6778

It would be interesting to see if vlimit would be exceeded if density
was equilibrated. How many atoms in this system? It may be not enough
to create a stable box.

Bill

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Received on Mon May 17 2010 - 10:30:03 PDT
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