Re: [AMBER] How to reshuffle traj frames

From: Daniel Roe <>
Date: Sat, 2 Oct 2021 09:13:20 -0400


Currently you would have to do it via a series of 'trajin' commands
which is not very elegant. It's a good idea for a feature: I've
created an issue on the cpptraj GitHub site and will try to implement
it soon:


On Fri, Oct 1, 2021 at 11:52 PM Matthew Guberman-Pfeffer
<> wrote:
> Dear Amber Community,
> I’ve computed a property for a series of frames. I’m wondering if there is a straightforward way to reshuffle these frames to form a pseudo trajectory with the frames in the order in which the property increases.
> Best,
> Matthew
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Received on Sat Oct 02 2021 - 06:30:03 PDT
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