[gmx-users] install and mdrun problems

Bogdanov, Vladimir bogdanov.7 at osu.edu
Mon Mar 2 17:21:49 CET 2020


Hi Dallas,

The temperature of CPU is fine, it is less than 59C. Mdrun started work properly after I changed Bios settings to the default settings.
________________________________
From: gromacs.org_gmx-users-bounces at maillist.sys.kth.se <gromacs.org_gmx-users-bounces at maillist.sys.kth.se> on behalf of Dallas Warren <dallas.warren at monash.edu>
Sent: Monday, March 2, 2020 1:14 AM
To: GROMACS users <gmx-users at gromacs.org>
Subject: Re: [gmx-users] install and mdrun problems

Sounds bit like it may be overheating. Are all ventilation fans fully
operational?

On Mon, 2 Mar. 2020, 2:38 pm Bogdanov, Vladimir, <bogdanov.7 at osu.edu> wrote:

> Hi all,
>
> I installed Gromacs2020 on ubuntu18.04 (nvidia-smi 440.59, CUDA 10.2), but
> when I did make check, my PC turned off. I also tried to install
> Gromacs2018.2, Gromacs2018.6 and I have got the same problem. When I tried
> to do mdrun, my PC also shut down. I also tried the following combination:
> nvidia-smi 440.59, CUDA 9.2.
>
> Any ideas would be helpful.
>
> Thanks,
> Vlad
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