On Wed, Apr 10, 2013 at 4:48 PM, 陈照云 <[email protected]> wrote:
> I have tested gromacs-4.6.1 with k20. > But when I run the mdrun, I met some problems. > 1.GPU only support float accelerating? > Yes. > 2.Configure options are -DGMX_MPI ,-DGMX_DOUBLE . > But if I run parallely with mpirun, it would get wrong with PMPI_Broadcast. > 3. Configure options are -DGMX_MPI ,-DGMX_GPU.But if I run with gpu, the > program would get wrong with the message'Segmentation Fault'. > Not enough information to help with any of those. Cheers, -- Szilárd > > Thanks for your help! > -- > gmx-users mailing list [email protected] > http://lists.gromacs.org/mailman/listinfo/gmx-users > * Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/Search before posting! > * Please don't post (un)subscribe requests to the list. Use the > www interface or send it to [email protected]. > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! * Please don't post (un)subscribe requests to the list. Use the www interface or send it to [email protected]. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
