The version of Gromacs is 4.0.7. This is the first time that I using Gromacs, then excuse me if I'm nonsense.
Wich part of md.log output should I post? after or before the input description? thanks for all, and sorry ________________________________ De: Carsten Kutzner <ckut...@gwdg.de> Para: Open MPI Users <us...@open-mpi.org> Enviadas: Domingo, 6 de Junho de 2010 9:51:26 Assunto: Re: [OMPI users] Gromacs run in parallel Hi, which version of Gromacs is this? Could you post the first lines of the md.log output file? Carsten On Jun 5, 2010, at 10:23 PM, lauren wrote: sorry my english.. > >I want to know how can I run Gromancs in parallel! >Because when I used > >mdrun & >mpiexec -np 4 mdrun_mpi -v -deffnm em > > to run the minimization in 4 cores > all cores make the same job, again! >They don't run together. >I want all in parallel make the job faster. > > >what could be wrong? > >thank's a lot! > > > > _______________________________________________ >users mailing list >us...@open-mpi.org >http://www.open-mpi.org/mailman/listinfo.cgi/users
