Hi,
> The test case can not pass in the Taiwan ALPS cluster.
> But the case can pass the in the my SMP machine.
Since the test case doesn't pass on your cluster this indicates the
issue is probably cluster-related; you should contact the cluster's
system administrator for help. Are you able to run any sander.MPI jobs
at all on your cluster, or is it just NEB?
-Dan
>
> YT
> -----Original message-----
> From:Daniel Roe <daniel.r.roe.gmail.com>
> To:c00jsw00.nchc.narl.org.tw,AMBER Mailing List <amber.ambermd.org>
> Date:Mon, 31 Oct 2011 08:09:57 -0400
> Subject:Re: [AMBER] Nudged Elastic Band (NEB) with torque PBS system
>
> Hi,
>
> You still haven't told us if the test cases pass for you or not.
> Without knowing at least that it's difficult to tell if it's a
> hardware or software issue.
>
> -Dan
>
>
> --
> -------------------------
> Daniel R. Roe, PhD
> Postdoctoral Associate
> BioMaPS Institute, Rutgers University
> 610 Taylor Road
> Piscataway, NJ 08854
>
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--
-------------------------
Daniel R. Roe, PhD
Postdoctoral Associate
BioMaPS Institute, Rutgers University
610 Taylor Road
Piscataway, NJ 08854
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Received on Thu Nov 10 2011 - 06:00:02 PST
