[gmx-users] Help of mdrun-gpu

Du Jiangfeng (BIOCH) j.du at maastrichtuniversity.nl
Fri Jul 27 16:58:10 CEST 2012

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,


    Jiangfeng Du, PhD Student
    Cardiovascular Research Institute Maastricht
    Department of Biochemistry
    P.O. Box 616
    Mobile: +31-681741859
    FAX: +31-43-3884159
    6200 MD Maastricht
    The Netherlands

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