AMBER Archive (2009)

Subject: Re: [AMBER] AMBER10: error message mdfil flag.....

From: David A. Case (case_at_biomaps.rutgers.edu)
Date: Wed Jun 03 2009 - 09:30:08 CDT


On Wed, Jun 03, 2009, Catein Catherine wrote:
>
> mpirun /amber10/exe/sander -i min.in ...
         ^^^^^^^^^^^^^^^^^^^

This is wrong: you have to run sander.MPI for parallel jobs, not just sander.

...dac

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