Re: [AMBER] CUDA and driver version for Nvidia Titan Black and Titan Z GPUs cluster

From: Markowska <markowska.kar.gmail.com>
Date: Fri, 7 Sep 2018 20:17:42 +0200

Thanks, Dave!

I'll send this email to my IT guys :)

Best
Karolina

pt., 7 wrz 2018 o 19:47 David Cerutti <dscerutti.gmail.com> napisał(a):

> We recommend CUDA 9.1 or 9.2 because of the performance benefits of the
> latest compilers (also the speed of compilation itself is improved).
> However, for Amber14 I'm not sure what compilers will work. You can
> probably run CUDA8 for a compromise between the old and new Amber.
> However, we have found some issues that were fixed in Amber18 (and
> retroactively in Amber16) but did not get ported all the way back to
> Amber14. Upgrading is always a good idea!
>
> Dave
>
>
> On Fri, Sep 7, 2018 at 1:37 PM Karolina Mitusińska (Markowska) <
> markowska.kar.gmail.com> wrote:
>
> > Dear Amber Developers and Users,
> >
> > I would like to ask you about cluster configuration.
> > We are using Amber14 on our Nvidia Titan Black and Titan Z clusters. We
> are
> > now running on CUDA 6.5 and 343.19 driver. Because we are also running on
> > Ubuntu 14.04 and it's a bit old fashioned now, we want to upgrade to
> Ubuntu
> > 18.04 and also (for other reasons) to Amber18.
> >
> > Can you suggest the driver and CUDA version that will suit us?
> > And will that configuration run smoothly with Amber14 also?
> >
> > Thanks for your help!
> > Best regards
> > Karolina Mitusińska
> > PhD student
> > _______________________________________________
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> > AMBER.ambermd.org
> > http://lists.ambermd.org/mailman/listinfo/amber
> >
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Received on Fri Sep 07 2018 - 11:30:03 PDT
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