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materialsvirtuallab / monty

This repository implements supplementary useful functions for Python that are not part of the standard library. Examples include useful utilities like transparent support for zipped files etc.
MIT License
72 stars 50 forks source link

release numpy <2 pin, and support python 3.13 #719

Open DanielYang59 opened 1 week ago

DanielYang59 commented 1 week ago

Summary by CodeRabbit

coderabbitai[bot] commented 1 week ago

Walkthrough

The changes in this pull request primarily involve modifications to the pyproject.toml and GitHub Actions workflow files. The pyproject.toml file updates the Python version requirements to restrict it to a maximum of 3.13 and removes the upper limit for the numpy dependency. Additionally, it introduces conditional dependencies for pint and torch based on the Python version. The GitHub Actions workflow is updated to reflect the new Python versions in the job matrix.

Changes

File Change Summary
pyproject.toml Updated requires-python to ">=3.9,<=3.13"; removed upper limit for numpy; added conditional dependencies for pint and torch.
.github/workflows/test.yml Updated python-version in job matrix from ["3.9", "3.12"] to ["3.9", "3.10", "3.11", "3.12", "3.13"]; reordered OS list and updated variable name to python.

Assessment against linked issues

Objective Addressed Explanation
Support Numpy 2 ✅
Support Python 3.13 ✅

🐰 Hopping through the code so bright,
Numpy's limits take flight!
With Torch by its side, oh what a sight,
Compatibility shines, all feels right!
Let's celebrate with a joyful cheer,
For changes that bring us near! 🎉

📜 Recent review details **Configuration used: CodeRabbit UI** **Review profile: CHILL**
📥 Commits Files that changed from the base of the PR and between 82f6dd19605f38ad8e9e049f2c4210d0d9e5b17c and 89c03fe27220e38b6e8d2f94ec32a90487163381.
📒 Files selected for processing (1) * .github/workflows/test.yml (1 hunks)
🚧 Files skipped from review as they are similar to previous changes (1) * .github/workflows/test.yml
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codecov[bot] commented 1 week ago

Codecov Report

All modified and coverable lines are covered by tests :white_check_mark:

Project coverage is 82.53%. Comparing base (1798d59) to head (d7a6d02).

Additional details and impacted files ```diff @@ Coverage Diff @@ ## master #719 +/- ## ========================================== - Coverage 82.57% 82.53% -0.05% ========================================== Files 27 27 Lines 1584 1580 -4 Branches 284 284 ========================================== - Hits 1308 1304 -4 Misses 215 215 Partials 61 61 ```

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