Re: AMBER: error when using sander.LES: exceeded MAXLES

From: David A. Case <case.scripps.edu>
Date: Thu, 18 Jan 2007 09:12:23 -0800

On Thu, Jan 18, 2007, Kailee wrote:

> Exceeded MAXLES 57536

You need to change the limits in $AMBERHOME/src/sander/les.h as well, since
this error is coming from sander, not from addles. Note that amber9 has a
much higher default limit than amber8, so this sort of problem should be less
common there.

...good luck....dac

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Received on Sun Jan 21 2007 - 06:07:24 PST
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