[gmx-users] query regarding running simulation using GPU
Mark Abraham
mark.j.abraham at gmail.com
Wed Mar 11 21:29:43 CET 2020
Hi,
Sure. With a GPU-enabled build, you can just continue running almost all
kinds of simulations.
Mark
On Wed, 11 Mar 2020 at 16:33, Snehasis Chatterjee <
snehasis.chatterjee18 at gmail.com> wrote:
> Dear Gromacs users,
>
> I am trying to perform a simulation for a relatively large system using
> GROMACS 2019. I was using CPU for running simulation and now, I have 100 ns
> data. But, now I have a access to use good quality GPU machine. I want to
> continue my simulation (after 100ns) using GPU. Is it possible to do
> that? I
> am bit confused regarding this issue.
>
> Any kind of advice/ suggestions will be deeply appreciated.
>
> Thanks in advance,
> Snehasis Chatterjee
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