Re: [AMBER] is there a batch queue app?

From: Jason Swails <jason.swails.gmail.com>
Date: Fri, 1 Jun 2012 15:22:32 -0400

You can also install torque from apt-get and google how to configure it.

On Fri, Jun 1, 2012 at 3:06 PM, Scott Le Grand <varelse2005.gmail.com>wrote:

> You can use gridengine but you need to manually specify which device you're
> running on with CUDA_VISIBLE_DEVICES on a per queue basis...
>
>
>
> On Fri, Jun 1, 2012 at 11:58 AM, Jonathan Gough
> <jonathan.d.gough.gmail.com>wrote:
>
> > is there a batch queue app that people use to run amber calculations on a
> > single machine?
> >
> > I am familiar with pbs/torque/moab for clusters. But does anyone use or
> > has anyone built one for a single machine and use it to run amber
> > calculations?
> >
> > (I know someone built a simple one to run to run gamess calcs (gamessQ).
> >
> > Thanks,
> > Jonathan
> > _______________________________________________
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> > AMBER.ambermd.org
> > http://lists.ambermd.org/mailman/listinfo/amber
> >
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>



-- 
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
352-392-4032
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Received on Fri Jun 01 2012 - 12:30:03 PDT
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