[gmx-users] problem with -multi

Berk Hess gmx3 at hotmail.com
Tue Jul 27 10:36:13 CEST 2004




>From: Nguyen Hoang Phuong <phuong at theochem.uni-frankfurt.de>
>Reply-To: Discussion list for GROMACS users <gmx-users at gromacs.org>
>To: gmx-users at gromacs.org
>Subject: [gmx-users] problem with -multi
>Date: Mon, 26 Jul 2004 18:18:25 +0200 (MEST)
>
>
>Dear All,
>
>we have tried to get mdrun run with the option -multi
>
>mpirun -np 2 mdrun_d -np 2 -multi -s x.tpr
>
>but we get this:
>
>Sorry couldn't backup flog0.log to
>NODEID=1 argc=14
>Sorry couldn't backup flog1.log to
>Fatal error: File x.tpr not found
>...
>
>We have already got the x0.tpr, x1.tpr in the running
>directory. I don't know why mdrun doesn't see these files. Any  idea?
>

This is a known bug and I have fixed it in CVS.
I'll send you the fix.

Berk.

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