Re: [AMBER] begin time read from input coords

From: Hannes Loeffler <Hannes.Loeffler.stfc.ac.uk>
Date: Fri, 26 Aug 2016 16:34:45 +0100

On Fri, 26 Aug 2016 09:11:04 -0400
David A Case <david.case.rutgers.edu> wrote:

> So: can you try to see what is different between your calculation and
> this test case? Maybe I am not understanding your description of the
> problem...can you make a small test case that illustrates the bad
> behavior?

Ok, found it. irest was set to zero in the first run which also sets
the time step counter to zero as documented.

Many thanks,
Hannes.

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Received on Fri Aug 26 2016 - 09:00:02 PDT
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