[gmx-users] trr file

[Nuno Azoia]

Hello Rita,

I think the answer is trjconv. Try to convert it to xtc, reduce the number
of frames (with dt or skip), or reduce the components on the trajectory. If
you don't need solvent for the calculations you can create a trajectory
without it. Removing the solvent and convert it to xtc should have a great
impact in file size.

Nuno Azoia

On Fri, Oct 14, 2016 at 11:04 AM, Rita Paiva Melo <
ritamelo at ctn.tecnico.ulisboa.pt> wrote:

> Dear all,
>
> Probably a rookie question but anyone knows how to reduce trajectory
> volume file to be analyzed (I have already tried trjconv)? I have a trr
> file with  167 GB and analysis tools crash.
>
> Thanks,
> Rita.
>
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