AMBER Archive (2008)

Subject: Re: AMBER: using NAB to calculate entropy. .

From: David A. Case (case_at_scripps.edu)
Date: Wed Feb 06 2008 - 15:37:40 CST

On Wed, Feb 06, 2008, Wang, Xuelin wrote:
>
> How can I incorporate NAB to the MM_PBSA calculation (in NMODE part) or
> I have to use NAB independently?

To start, you would have to use nab independently. After you learn that, you
could of course modify mm-pbsa to automate the process, if you wished.

...dac

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