[gmx-users] Re: Parallel instalation: gmx-users Digest, Vol 74, Issue 76

[Carsten Kutzner]

On Jun 17, 2010, at 3:42 PM, abdul wadood wrote:

> Dear Carsten 
> 
> the command which i give is 
> 
> mpiexec -l -np 4 /usr/local/gromacs/bin/mdrun_mpi -s topol.tpr
> 
> with this command the same error come which is 
> 
> Can not open file:
> 3: topol.tpr
> 3: -------------------------------------------------------
Maybe "." (the current directory) is not in your path. Either try

mpiexec -l -np 4 /usr/local/gromacs/bin/mdrun_mpi -s ./topol.tpr

or give the full path name:

mpiexec -l -np 4 /usr/local/gromacs/bin/mdrun_mpi -s  /absolute/path/to/topol.tpr

Carsten



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