Re: Amber 7 MM-PBSA for Amber 6 trajectories

From: David A. Case <case_at_scripps.edu>
Date: Sat 14 Dec 2002 11:26:01 -0800

On Thu, Dec 12, 2002, Qing Zhang wrote:
>
> I produced Amber 6 trajectories for my system, but I
> want to use Amber 7's MM-PBSA scripts to calculate the
> free energies. Is that compatible? Will the free
> energies be different?

The format of trajectory files has not changed between versions 6 and 7, so
I don't believe you should have any problems.

..good luck...dac 


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David A. Case                     |  e-mail:      case_at_scripps.edu
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Received on Sat Dec 14 2002 - 11:26:01 PST
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