I have the same problem and change iwrap=1 to 0, but the problem still exist
----- Original Message -----
From: Bill Ross <ross.cgl.ucsf.EDU>
Date: Thursday, July 1, 2010 9:49 am
Subject: Re: [AMBER] vlimit exceeded for step
To: amber.ambermd.org
> > I checked my input file for MD, I always used the iwrap=1 to
> control I/O.
>
> It might be interesting to try running a few (10? 100? 1000?) steps
> with iwrap=0 and then restarting with iwrap=1 again to see if it
> gets you out of this problem.
>
> Bill
>
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Received on Wed Jun 30 2010 - 22:30:04 PDT
