AMBER Archive (2005)

Subject: Re: AMBER: Time Correlation Functions with Amber

From: David A. Case (case_at_scripps.edu)
Date: Tue Nov 08 2005 - 10:25:50 CST


On Tue, Nov 08, 2005, John S Zintsmaster wrote:
>
> i'm am trying to calculate time correlation functions with amber 8 and i
> am running into major brick walls. has anyone out there successfully
> calculated a time correlation function via ptraj? is it possible? if so,
> i would very much like to here about your experience.

I do this all the time. But without knowing what problems you have, I don't
see how I can help much.

...dac

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