[gmx-users] mpirun

TH Chew teonghan at gmail.com
Thu Mar 29 11:37:39 CEST 2012


Where did you install your Gromacs? Most likely the executables are not in
the PATH.

On Thu, Mar 29, 2012 at 5:09 PM, cuong nguyen <nvcuong68 at gmail.com> wrote:

> Dear Gromacs Users,
>
> as in the manual, I tried to run the simulation on 4 processors and used
> the command as follow:
> *mpirun -np 4 mdrun_mpi -s NVT_50ns -o NVT_50ns -c NVT_50ns.g96 -x
> NVT_50ns -e NVT_50ns -g NVT_50ns -v*
>
> Then I got the error:
> *mpirun was unable to launch the specified application as it could not
> find an executable:
>
> Executable: mdrun_mpi*
> Please help me to deal with this problem.
>
> Best regards,
>
>
> Nguyen Van Cuong
> PhD student - Curtin University of Technology
> Mobile: (+61) 452213981
>
>
>
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-- 
Regards,
THChew
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