Itamar Kass wrote:
Hi,
I think it is more important how you compiled you gromacs. Had you used
--enable-mpi?
Indeed, that is also very important.
Itamar
On Sun, Nov 8, 2009 at 2:08 AM, milad ekramnia <[email protected]
<mailto:[email protected]>> wrote:
Hi Mark
my mdrun command line is :
mpirun -n 4 mdrun_mpi -v -s topol.tpr
That's great, but I no longer remember the context of your question.
Please reply to the previous email and leave the content.
If you are using GROMACS 3.x then you may need to give a -np flag to
grompp and mdrun_mpi also.
Mark
--
gmx-users mailing list [email protected]
http://lists.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/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/mailing_lists/users.php
