Re: MD- GPU

From: Aron Broom (broomsday_at_gmail.com)
Date: Thu Oct 03 2013 - 07:06:24 CDT

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please read the extensive user manual, particularly, the comprehensive
section called "Running NAMD".

On Thu, Oct 3, 2013 at 7:51 AM, Sagar Gore <gore.scb_at_gmail.com> wrote:

> Dear All,
>
> I am new to NAMD and have a question regarding use of GPUs along with
> multiple cores for MD simulation.
> We have Tesla K20 C NVIDIA graphics card and amdcpu with 32 cores. We want
> to use all 32 cores along with one GPU for MD simulations. Please help me
> with this by giving executables and right commands to run MD simulation.
> Thank you,
>
> Yours Sincerely,
> Sagar Gore
>

-- 
Aron Broom M.Sc
PhD Student
Department of Chemistry
University of Waterloo

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