Re: [gmx-users] Gromacs-GPU help
Hi, This may also be helpful: http://www.hecbiosim.ac.uk/jade-benchmarks https://github.com/hpc-uk/archer-benchmarks/blob/master/reports/single_node/index.md#tab16 Regards, Benson On 8/16/19 5:45 AM, Benson Muite wrote: Hi, You may wish to search the list archives as indicated at: Please search the archive athttp://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! 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 | | | | | | | | | | | Run GROMACS 3X Faster on NVIDIA GPUs Complete your molecular dynamics simulations in hours instead of days. Learn more. | | | 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 -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
Re: [gmx-users] Gromacs-GPU help
Hi, You may wish to search the list archives as indicated at: Please search the archive athttp://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! 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 | | | | | | | | | | | Run GROMACS 3X Faster on NVIDIA GPUs Complete your molecular dynamics simulations in hours instead of days. Learn more. | | | 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 -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
[gmx-users] Gromacs-GPU help
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 | | | | | | | | | | | Run GROMACS 3X Faster on NVIDIA GPUs Complete your molecular dynamics simulations in hours instead of days. Learn more. | | | 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 -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
