[gmx-users] [Fwd: found problem in continual run]
David van der Spoel
spoel at xray.bmc.uu.se
Mon Nov 14 09:00:30 CET 2005
-------- Forwarded Message --------
From: chiloo Laohpongspaisan <chiloo77 at yahoo.com>
To: spoel at gromacs.org
Subject: found problem in continual run
Date: Sun, 13 Nov 2005 18:21:46 -0800 (PST)
Dr. David,
i face the problem in md running. i don't know what's wrong because this
job is continual and i ran the simulation 9 ns before and need a little
more but i've found an error as follow:
Reading file md10.tpr, VERSION 3.2.1 (single precision)
Fatal error: run input file md10.tpr was made for 2 nodes,
while mdrun expected it to be for 1 nodes.
Please suggest me,
Best regards,
Chiloo
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--
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://xray.bmc.uu.se/~spoel
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