A small suggested change to g_tune_pme. Allowing the specification of the executable on all the nodes would be appreciated since I (at least) follow the suggestion in the installation directions and suffix my parallel version of mdrun with _mpi, so the executable is mdrun_mpi, not mdrun.
You might also want to point out, in the documentation, that one can include the normal mpi commands in the g_tune_pme command. For example, ./g_tune_pme -np 24 -hostfile ethfile24 -s cpeptide_md_PME.tpr works just fine. Jim _______________________________________________ gmx-users mailing list gmx-users@gromacs.org 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 gmx-users-requ...@gromacs.org. Can't post? Read http://www.gromacs.org/mailing_lists/users.php
