AMBER Archive (2008)

Subject: Re: AMBER: box shape changed at NVT

From: David A. Case (
Date: Wed Jun 11 2008 - 10:18:46 CDT

On Wed, Jun 11, 2008, wrote:
> The shape of my simulation box has changed despite running at constant
> volume ?

What is your (detailed) evidence that this is happening? Either you are not
really running NVT, or the box shape is not really changing, (or you have
encountered a new bug). We can't help without knowing what you did, and what
makes you think the box shape is changing.


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