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From: Peter (peter.mawanga.lagos_at_gmail.com)
Date: Thu Feb 27 2025 - 15:29:18 CST

Sorry for messaging again in this thread. It is a bit urgent, and I request
an alternate avenue for me to pose this question.

The only way I could think of is to write the individual frames and then
combine them into a single trajectory file. However, this would generate a
lot of frames, and I am not sure they would be in the correct order for the
combined trajectory.

On Tue, Feb 25, 2025 at 1:23 AM Peter <peter.mawanga.lagos_at_gmail.com> wrote:

> Hello everyone,
>
> I would like to calculate an average PDB structure with the "measure
> avpos" command using only certain frame numbers of the simulation
> trajectory.
>
> Therefore, I was wondering if it is possible to supply a list of frames to
> the measure command. I could only find the option of supplying a single
> frame number or a range of frame numbers.
>
> Any suggestions for a workaround would be greatly appreciated.
>
>
> --
> Cheers
> Peter
>