On Tue, 2008-11-18 at 09:39 +0100, Antoine Migeon wrote: > Hello, > > I have many problem for install Gromacs in Centos 5.2, without MPI for > the moment. > > I tried you solution, but the package contain only binary prefixed by > "g_", and the test set doesn't find grompp. > (after source /usr/bin/GMXRC) > > What the problem ?
All of the binaries have been renamed to begin with g_, so grompp is g_grompp, and mdrun is g_mdrun. Double precision binaries are suffixed _d. MPI binaries are suffixed _mpi (_mpi_d for double precision). Example: g_mdrun (single precision) g_mdrun_d (double precision) g_mdrun_mpi (single precision, MPI) g_mdrun_mpi_d (double precision, MPI) You don't have to source GMXRC, it is done automatically. -- ------------------------------------------------------ Jussi Lehtola, FM, Tohtorikoulutettava Fysiikan laitos, Helsingin Yliopisto [EMAIL PROTECTED], p. 191 50632 ------------------------------------------------------ Mr. Jussi Lehtola, M. Sc., Doctoral Student Department of Physics, University of Helsinki, Finland [EMAIL PROTECTED] ------------------------------------------------------ _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.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
