Re: AMBER: questions about run MD at different pH

From: David A. Case <>
Date: Tue, 15 Apr 2008 13:59:27 -0700

On Tue, Apr 15, 2008, Taufik Al-Sarraj wrote:

> nonetheless can AMBER9 calculate pH?

The pH is an *input* parameter to constant pH simulations. Otherwise, Amber9
doesn't "calculate" pH.


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Received on Fri Apr 18 2008 - 21:19:38 PDT
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