[gmx-users] Gromacs on GPU

[Esteban Gabriel Vega Hissi]

Hi,
It is not possible.
Any code requires a sequential section that is run on the CPU, and the
parallel section (when it is possible to parallelized) is evoqued from the
CPU to be run in the GPU.
I recommend you to read about GPU programming basics.

Greetings.


On Fri, Jan 20, 2012 at 10:16 AM, <aiswarya.pawar at gmail.com> wrote:

> Hi Users,
>
> Is it possible to run gromacs executables solely on GPU (nvidia with cuda
> libraries) without using CPU. Where can I get more information about this.
>
> Thank you,
> Aiswarya
> Sent from my BlackBerry® on Reliance Mobile, India's No. 1 Network. Go for
> it!
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-- 
Esteban Gabriel Vega Hissi
Área de Química Física
Departamento de Química
Universidad Nacional de San Luis
Argentina
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