Re: [AMBER] Amber on GPU

From: emanuele falbo <falbo.emanuele.gmail.com>
Date: Thu, 20 Sep 2018 12:23:04 +0100

Hey Dac,

thanks for the useful hint , I'll give it a go.

Cheers.

Il giorno gio 20 set 2018 alle ore 12:15 David A Case <
david.case.rutgers.edu> ha scritto:

> On Thu, Sep 20, 2018, emanuele falbo wrote:
> >
> > I would like to use the AMBER on the GPU-machine. However, I don't know
> > whether there is any difference in installing AMBER on GPU-machine from
> the
> > normal procedure for the CPU-machines?
>
> Please see the installation instructions in the Amber 2018 Reference
> Manual. Basically, you need to install the CPU version (using the
> configure script in your AMBERHOME directory); after that, re-running
> configure with the "-cuda" option will install GPU versions.
>
> ....dac
>
>
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-- 
*Emanuele Falbo*
PhD student
Penfold group
School of Natural and Environmental Sciences
Bedson Building, Newcastle University
Newcastle upon Tyne, NE1 7RU
w: http://tompenfoldresearch.weebly.com/
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Received on Thu Sep 20 2018 - 04:30:02 PDT
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