Hi Berk,
thanks for your answer. I've checked the charge groups and every thing
seems to be ok (no single groups...). Actually I'm using 3.2.1
version, but it doesn't seem to be depending on that.
What could I check?
Fabio
On May 8, 2008, at 4:00 PM, [EMAIL PROTECTED] wrote:
------------------------------
Message: 3
Date: Thu, 8 May 2008 15:21:16 +0200
From: Berk Hess <[EMAIL PROTECTED]>
Subject: RE: [gmx-users] crash nsgrid.c
To: Discussion list for GROMACS users <[email protected]>
Message-ID: <[EMAIL PROTECTED]>
Content-Type: text/plain; charset="iso-8859-1"
Hi,There can be many reasons for such problems.I assume you use
solvent.One option is that you could have made your whole proteina
single charge group. grompp in Gromacs 3.3.3 checks for this,but
older versions do not.Berk
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