[gmx-users] Error with Energy minimisation
omovie_johnnie at hotmail.com
Sun May 20 05:12:48 CEST 2007
No, I dont have another parallel program. Fortunately, l have the serial
program installed. So I'll use that instead.
>From: Mark Abraham <Mark.Abraham at anu.edu.au>
>Reply-To: Discussion list for GROMACS users <gmx-users at gromacs.org>
>To: Discussion list for GROMACS users <gmx-users at gromacs.org>
>Subject: Re: [gmx-users] Error with Energy minimisation
>Date: Sun, 20 May 2007 10:47:05 +1000
>Sheyore Omovie wrote:
>>I was trying out the Ribonuclease S-peptide simulation in the online
>>I get the following error message when I try to do energy minimisation:
>>'<MPICH-MX> Error: Need to obtain the job magic number in MXMPI_MAGIC'
>>What could I have done wrong?
>This is some problem with MPI... can you run other parallel programs?
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