[gmx-users] concatenate NAMD trajectories
Natal Kanaan
kanaan at zedat.fu-berlin.de
Thu Aug 14 16:05:24 CEST 2014
Hi again,
thanks a lot, it works!
Natal
>
>
> On 8/14/14, 9:16 AM, Natal Kanaan wrote:
>> Hi,
>> thanks a lot for your quick reply, but I still have a doubt about how to
>> "translate" my trjcat command to trjconv:
>> trjconv -t0 -timestep XX -f one.dcd two.dcd three.dcd -o total
>
> trjconv does not accept multiple entries to -f. Use the concatenated .dcd
> file
> from trjcat.
>
>> what do I need to add instead of "-t0"?
>> should I add my timestep instead of XX (in ps)?
>
> Please read trjconv -h.
>
> -Justin
>
> --
> ==================================================
>
> Justin A. Lemkul, Ph.D.
> Ruth L. Kirschstein NRSA Postdoctoral Fellow
>
> Department of Pharmaceutical Sciences
> School of Pharmacy
> Health Sciences Facility II, Room 601
> University of Maryland, Baltimore
> 20 Penn St.
> Baltimore, MD 21201
>
> jalemkul at outerbanks.umaryland.edu | (410) 706-7441
> http://mackerell.umaryland.edu/~jalemkul
>
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