Thanks vdSpoel, Just one more question.
So, in a dual/quad core computer, do -sort -shuffle do any difference for better? I mean, is there use for 'sort and shuffle' in a multi-core computer (not cluster!)? Cheers, Alan On Tue, Jul 22, 2008 at 4:26 PM, Alan <[EMAIL PROTECTED]> wrote: > Hi list! > > I would like to know among mac intel users with Fink, which gromacs > with mpi to use: > > gromacs-mpi-lammpi or > gromacs-mpi-openmpi > > Or there's any easier way (multi-threads is still not working in GMX, right?)? > > > > Many thanks in advance. > Alan > > -- > Alan Wilter S. da Silva, D.Sc. - CCPN Research Associate > Department of Biochemistry, University of Cambridge. > 80 Tennis Court Road, Cambridge CB2 1GA, UK. >>>http://www.bio.cam.ac.uk/~awd28<< > -- Alan Wilter S. da Silva, D.Sc. - CCPN Research Associate Department of Biochemistry, University of Cambridge. 80 Tennis Court Road, Cambridge CB2 1GA, UK. >>http://www.bio.cam.ac.uk/~awd28<< _______________________________________________ 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
