Re: AMBER: questions about run MD at different pH

From: Taufik Al-Sarraj <taufik.alsarraj.utoronto.ca>
Date: Tue, 15 Apr 2008 17:47:10 -0500

that helps thank you

David A. Case wrote:
> 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.
>
> ...dac
>
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Received on Fri Apr 18 2008 - 21:19:39 PDT
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