[gmx-users] Help of mdrun-gpu
Mark.Abraham at anu.edu.au
Sat Jul 28 03:13:30 CEST 2012
On 28/07/2012 12:58 AM, Du Jiangfeng (BIOCH) wrote:
> Dear All,
> I just configured the mdrun-gpu. When I tested "mdrun-gpu" by running gromacs-gpubench-dhfr.tar.gz which is from gromacs website. Unfortunately, it failed with segmentation fault. I don't think the system has any equilibrium problem since it works fine in "mdrun". I will appreciate a lot if anyone could help me for it.
> Best Wishes,
Have you read the available documentation? Do you have a supported GPU?
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