> David, thanks for answering. > strange. i've installed one version of gromacs on the front end machinne > but > when it tries to run mprun_mpi it says that cannot find it (obvously > because > is searching on a node that is not the frontend machinne). > Where can i find a step by step example of working with gromacs-mpi??? > I'm the administrator of the cluster and know nothing about molecules :(
It sounds like your problem is installing software on Rocks clusters, not with gromacs. I think a tutorial on the former would be more helpful than one on the latter. Mark _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users 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
