AMBER Archive (2008)

Subject: Re: AMBER: questions about run MD at different pH

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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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