Hi,
We also intend that this does not happen. But none of the developers use
these features much, so we need help in the form of reproducible bug
reports, please :-)
Mark
On Mon, Aug 6, 2018, 01:29 Alex wrote:
> To be fair, Gromacs does die with absolutely nothing in all logs once in
> a
To be fair, Gromacs does die with absolutely nothing in all logs once in
a while, and it is not due to queue management, of which we have none.
In my case, with a 100% probability, it happens when the setup is
garbage, like your boundaries are crap, or you mixed up angstroms with
nanometers in
Hi,
Both the log file and the street output have the reason if GROMACS
understands the reason. Most likely on the information you've given is that
the queue/cluster killed the job.
Mark
On Sat, Aug 4, 2018, 08:31 Atila Petrosian
wrote:
> Hi all,
>
> I am doing md simulation. But mdrun stopped
Update your log file, that would help us know better about the reason
behind it.!
On Sat, 4 Aug 2018 at 12:01 PM, Atila Petrosian
wrote:
> Hi all,
>
> I am doing md simulation. But mdrun stopped without any error in log file.
>
> I repeated it. But mdrun stopped again in another step.
>
> What
Hi all,
I am doing md simulation. But mdrun stopped without any error in log file.
I repeated it. But mdrun stopped again in another step.
What is the reason of stopping.
Best,
Atila
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