Hi,
What you have shown is just a generic failure message.
It is very likely that there additional clues in other
output files. You should inspect all the outputs,
double check your inputs, and compare the parallel job
to the serial job (it is standard operating procedure to
only run in parallel after you have successfully ran
a similar, perhaps smaller, job in serial).
If you still cannot find the problem then repost with
verbose and verbatim details.
scott
On Tue, Jul 26, 2011 at 12:16:32AM -0500, Rajesh Raju wrote:
>
> I submitted mmpbsa calculation with MMPBSA.MPI parallel version. I got
> an error message like this
>
> Activated Environment for using: Intel MKL v10.2.6.038.
> Activated environment for using: Intel Compilers, version 11.1 (073)
> Activated environment for using: OpenMPI, version 1.4.3
> Activated Environment for using: Intel MKL v10.2.6.038.
> Activated environment for using: Intel Compilers, version 11.1 (073)
> Activated environment for using: OpenMPI, version 1.4.3
> mpirun: killing job...
>
> --------------------------------------------------------------------------
> mpirun was unable to cleanly terminate the daemons on the nodes shown
> below. Additional manual cleanup may be required - please refer to
> the "orte-clean" tool for assistance.
> --------------------------------------------------------------------------
> node073
> node074
>
>
> Wat is this? is it a bug of the MMPBSA.MPI? How can i solve this
> problem?
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Received on Tue Jul 26 2011 - 00:00:03 PDT
