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MDAnalysis / PathSimAnalysis

An MDAKit that calculates the geometric similarity of molecular dynamics trajectories using path metrics such as the Hausdorff or Fréchet distances.
https://mdanalysis.org/PathSimAnalysis
GNU Lesser General Public License v2.1
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New release #15

Closed IAlibay closed 11 months ago

IAlibay commented 11 months ago

With python 3.12 support added in #11 we should make a new release so we can have py3.12 wheels on conda-forge.

orbeckst commented 11 months ago

I'll do a release.

orbeckst commented 11 months ago

@IAlibay are you working on the release? I just saw the 1.1.0 tag appear. If you're in the middle of it I won't get in your way, otherwise I'll be happy to do the rest, basically using https://github.com/MDAnalysis/mdanalysis/wiki/Guide-for-Maintainers as initial guidance.

IAlibay commented 11 months ago

Yeah sorry, I should have mentioned. I thought if all that was needed was a tag and a click for the release I might as well get it done whilst I had the repo open 😅

orbeckst commented 11 months ago

No worries, thanks for doing it!

On Jan 6, 2024, at 11:34, Irfan Alibay @.***> wrote:

Yeah sorry, I should have mentioned. I thought if all that was needed was a tag and a click for the release I might as well get it done whilst I had the repo open 😅

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IAlibay commented 11 months ago

And done !