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On Wed, Oct 24, 2012 at 11:47 AM, Mark Abraham wrote:
> mdrun will not leak memory that badly. I would guess your output buffers
> are not being flushed, so grow without bound.
>
> Mark
> On Oct 25, 2012 12:36 AM, "
Dear users,
I'm running a NVT simulation with gromacs 4.5.5,using
the command:
mdrun -nt $NSLOTS
and the memory usage grows without bounds until a crash with the message
/opt/gridengine/default/spool/compute-0-8/job_scripts/1711: line 29: 25200
Killed /usr/local/bin/md
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