Re: [AMBER] mpi error in Amber16

From: case <>
Date: Mon, 30 Jan 2017 17:52:46 -0500

On Mon, Jan 30, 2017, Hirdesh Kumar wrote:

> I recently installed Amber16 on my system. I am trying to perform all-atom
> MD simulation of my system (protein-ligand).
> *Primary job terminated normally, but 1 process returneda non-zero exit
> code.. Per user-direction, the job has been
> aborted.

Have you looked a the min2.out file to see if there is an error message there?
Does it look like the job completed? Did you get a min2.rst file?


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Received on Mon Jan 30 2017 - 15:00:03 PST
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