[gmx-users] .xtc and .trr file is missing

Tsjerk Wassenaar tsjerkw at gmail.com
Mon Jun 22 09:21:18 CEST 2015


Hi RJ,

For an XTC file, you need to set nstxtcout (GMX 4.x) or nstxout_compressed
(GMX 5). A TPR file is a run _input_ file and is not generated as output.

Cheers,

Tsjerk

On Mon, Jun 22, 2015 at 6:11 AM, RJ <rajiv at kaist.ac.kr> wrote:

> Dear gmx.
>
>
> I run 100ns simulation of my protein with ligand. After completing the
> 100ns, the output doesnt give .xtc and .tpr files of final output. i could
> find .cpt .edr .gro .tpr files of final output.
>
>
> Please guide me how can i get the final output of these files ? Thanks
> --
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-- 
Tsjerk A. Wassenaar, Ph.D.


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