[gmx-users] Re: gmx-users Digest, Vol 95, Issue 60

Hi, so further to my last email, I have run a quick test on my desktop machine (4 cores, 12Gb RAM). It seems that when running the parrinello-rahman barostat with domain decomposition (-dd 2 2 1) that I'm still getting memory leak (this time with GNU compilers). I followed proper equilibration wit

[gmx-users] Re: gmx-users Digest, Vol 95, Issue 60

On 9 March 2012 13:03, gmx-users-requ...@gromacs.org < gmx-users-requ...@gromacs.org> wrote: > Send gmx-users mailing list submissions to >gmx-users@gromacs.org > > To subscribe or unsubscribe via the World Wide Web, visit >http://lists.gromacs.org/mailman/listinfo/gmx-users > or,