Re: [gmx-users] help on mdrun

I am not sure I can give an affirmative working answer, but you may check ssh to each node, use "top" to see whether it's really run or just occupy the node but not use. On Sat, Jul 9, 2011 at 8:56 AM, Mark Abraham wrote: > On 9/07/2011 3:37 AM, raghu...@bcpindia.org wrote: >> >> Hi >> >> >> I

Re: [gmx-users] help on mdrun

On 9/07/2011 3:37 AM, raghu...@bcpindia.org wrote: Hi I have a problem related to submitting a mdrun job on cluster. I tried to ask help or gromacs and rocks users-group. My machine specs. Cluster of Intel Xeon processors:QC with Rocks Cluster. 8 processors (16 threads) When I submit md

[gmx-users] help on mdrun

Hi I have a problem related to submitting a mdrun job on cluster. I tried to ask help or gromacs and rocks users-group. My machine specs. Cluster of Intel Xeon processors:QC with Rocks Cluster. 8 processors (16 threads) When I submit mdrun -deffnm umbrella0 -pf pullf-umbrella0.xvg -px p