Re: [AMBER] AMBER benchmarks

From: Hannes Loeffler <Hannes.Loeffler.stfc.ac.uk>
Date: Fri, 25 Sep 2015 11:26:08 +0100

On Fri, 25 Sep 2015 18:05:55 +0800
Neha Gandhi <n.gandhiau.gmail.com> wrote:

> Dear List,
>
> Most of the simulations from AMBER verion 12 onwards have moved
> towards using cuda based pmemd and the benchmarks are available for
> the same. I was wondering if anyone has reported AMBER benchmarks
> (protein in explicit water) on a Cray HPC systems or similar using
> cpus?

http://www.hecbiosim.ac.uk/benchmark

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Received on Fri Sep 25 2015 - 03:30:05 PDT
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