[gmx-users] shorten the .job output

[herbst at fhi-berlin.mpg.de]

> Mark Abraham wrote:
>> herbst at fhi-berlin.mpg.de wrote:
>>
>>> Hi all,
>>>
>>> I am doing MD simulations with a length of 500 ns and I am getting a
>>> .job
>>> file with a size of ca. 1 GB for every simulation. I would like to
>>> change
>>> the output, so that the .job file is updated only every tenth timestep
>>> and
>>> it does not take up so much memory anymore.
>>> How can I do this ?
>>
>>
>> I'm not sure what a .job file is. However, if you read the gromacs
>> manual, the cunningly-titled section "7.3.7 Output control" will point
>> you in the right direction for changing the frequency of a variety of
>> outputs.
>
> You probably want to skip the -v option to mdrun

But that would produce no .job file at all, wouldn´t it ? Can I do nothing
to just lower the output frequency ?

>
>>
>> Mark
>> _______________________________________________
>> gmx-users mailing list
>> gmx-users at gromacs.org
>> http://www.gromacs.org/mailman/listinfo/gmx-users
>> Please don't post (un)subscribe requests to the list. Use the www
>> interface or send it to gmx-users-request at gromacs.org.
>
>
> --
> David.
> ________________________________________________________________________
> David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
> Dept. of Cell and Molecular Biology, Uppsala University.
> Husargatan 3, Box 596,  	75124 Uppsala, Sweden
> phone:	46 18 471 4205		fax: 46 18 511 755
> spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
> ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
> _______________________________________________
> gmx-users mailing list
> gmx-users at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to gmx-users-request at gromacs.org.
>