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Is there a plan to support Python 3.12?
Ubuntu 24.04 is out now, and it only comes with Python 3.12; none of the older Python versions are available in the official APT repos. It would be great if…
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Note: it may be that we just have too complex a CI pipeline and instead we need to slim things down.
## Background
Currently we run a single CI matrix for both "latest" and "develop", this is no…
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On https://mdakits.mdanalysis.org/mdakits.html, describe the columns of the table and what the "latest/develop passed" banners mean.
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When https://github.com/MDAnalysis/mdanalysis/pull/3753 is merged we'll need to update the guessing tutorials here.
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### Expected behaviour
All tests pass.
### Actual behaviour
```
Ran 4554 tests in 572.048s
FAILED (SKIP=16, failures=1)
```
### Code to reproduce the behaviour
On Fedora rawhide (27) runni…
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I could not used the exact commands listed in the instructions.md file of this git. I need to run that issue by Vivek so I will make a ticket for that as well. For now though the bitbucket I was using…
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Support potentially trajectory smoothing when importing an MD trajectory via MDAnalysis. (https://docs.mdanalysis.org/stable/documentation_pages/transformations/positionaveraging.html)
Potential fo…
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## Additional Information
- This issue is originally found in [Issue 3925](https://github.com/MDAnalysis/mdanalysis/issues/3925#issuecomment-1868292405). Please have a look in that conversation.
…
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I'm pretty new to using `AnalysisBase` to write my own custom analysis classes, and I found it confusing that `frames` and `times` are handled differently in different classes.
Using the `NewAnalys…
edisj updated
2 weeks ago
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Remove visualization package
- [ ] code
- [ ] tests
- [ ] CI
- [ ] add note to #4539