[gmx-users] Gromacs 4.5.5 GPU Error

[Szilárd Páll]

Hi,

Could you compile in Debug mode and run mdurn-gpu in gdb, it will tell
more about the location and type of exception.

--
Szilárd



On Mon, Mar 12, 2012 at 8:47 AM, TH Chew <teonghan at gmail.com> wrote:
> Hi all,
>
> I am trying to get the GPU version of gromacs running. I manage to install
> OpenMM, compile and install mdrun-gpu. However when I ran mdrun-gpu on any
> of the benchmark files, I got this:
>
> ./run.sh: line 2: 14224 Floating point
> exception/usr/local/gromacs-4.5.5-cuda/bin/mdrun-gpu -v
>
> Any idea what goes wrong here?
>
> --
> Regards,
> THChew
>
> --
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