Hello, I would like to install GROMACS on a cluster of Volta nodes. I have openmpi_3.1.1 and pgi_openmpi_2.1.2
available. For of them I get the message -- MPI is not compatible with thread-MPI. Disabling thread-MPI. However, I really would like to have this to take advantage of all 8 GPUs Have any of you encountered this problem? Thanks for your advice, Gabriele -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
