[gmx-users] [Fwd: TFE 33%]
Mark Abraham
Mark.Abraham at anu.edu.au
Sun Feb 18 00:50:36 CET 2007
Please keep these requests on the mailing list, so that others might be
able to answer your question better than I, and that the answer can be
found by others later.
Mark
-------- Original Message --------
Subject: TFE 33%
Date: Sat, 17 Feb 2007 08:55:08 -0800 (PST)
From: kourosh bamdad <kbamdad at yahoo.com>
To: mark.abraham at anu.edu.au
Dear prof. ABRAHAM
its more than 10 days that i've been dealing with a simple simulation
using a TFE & SPC for my solvent box but i stopped every time at the
(steep or em.mdp) stuff all the time. It send me this message: number of
coordinates in coordinate file does not match topology ( xxxx.pdb, top
0) !!!! what should i do to over this step? do i need to change xxxx.top
file whith something? or the error backs to the steep or em.mdp stuff?
Thanks
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