[gmx-users] mdrun failed
mailmd2011 at gmail.com
Thu May 15 17:40:02 CEST 2014
thanks a lot for reply.
The MPI works fine in my machine when I run another problem.
How can I check whether gromacs cmake picked up the MPI that I expected?
I've already specified with options:
thx a lot
On 05/15/2014 05:35 PM, Mark Abraham wrote:
> First, check your install of MPI works on a simple test program. Then,
> check that GROMACS cmake picked up the MPI you expected, and that that's
> really the one you're using at run time.
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