Re: [gmx-users] Gromacs-4.0: 4 CPUs crashes, works on 1 CPU

Berk Hess skrev: Hi, Could you file a bugzilla report and attach the tpr file? Please also mention at what step you get this error (run mdrun -v to get the step numbers). Berk Sure, no problem. Regards Andreas ___ gmx-users mailing listgmx-user

RE: [gmx-users] Gromacs-4.0: 4 CPUs crashes, works on 1 CPU

Hi, Could you file a bugzilla report and attach the tpr file? Please also mention at what step you get this error (run mdrun -v to get the step numbers). Berk > Date: Tue, 4 Nov 2008 13:36:59 +0100 > From: [EMAIL PROTECTED] > To: gmx-users@gromacs.org > Subject: [gmx-users] Gromacs-4.0: 4 CPUs

Re: [gmx-users] Gromacs-4.0: 4 CPUs crashes, works on 1 CPU

Andreas Kring skrev: Hi all. I have just installed GROMACS 4.0. My system consists of one hydroxide ion and 999 polarizable water molecules. When the system is minimized (using only one CPU) with a steepest descent minimizer, there are no problems. But when I try to minimize exactly the same