[gmx-users] Gromacs-GPU help

[Benson Muite]

Hi,

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See also:

https://arxiv.org/abs/1903.05918

Benson

On 8/16/19 5:37 AM, tarzan p wrote:
> Hi all,I have started using GROMACS recently on my work station (2 X Intel 6148 (20 cores each) and 2 x tesla v100 .I have compiled it as per the instructions atRun GROMACS 3X Faster on NVIDIA GPUs
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> Complete your molecular dynamics simulations in hours instead of days. Learn more.
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> I would like to get request for a proper benchmark for GPU version and would like to know how to run the GPU version. I mean the command to use one GPU and 2 GPU(s).
> With best wishes