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CHANGELOG.md

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Changelog

All notable changes to this project will be documented in this file.

The format is based on Keep a Changelog, and this project adheres to Semantic Versioning.

Unreleased

Authors

  • IAlibay

Changed

  • In accordance with SPEC0 the minimum Python version has been raised to v3.10 (PR #36)
  • Minimum supported MDAnalysis version has been raised to v2.1.0 (PR #36)

[1.1.0] -- 2024-01-06

Authors

  • IAlibay

Added

  • Added conda-forge install instruction to docs (Issue #13, PR #14)
  • Support for Python 3.12 (Issue #11, PR #12)

Fixed

  • Changed logger to no longer point to MDAnalysis.analysis

Changed

  • Switch from versioneer to versioningit

1.0.1 -- 2023-10-26

Authors

  • ianmkenney

Added

  • GitHub action workflow for automatic PyPI package deployment (PR #3)

Fixed

  • pyproject.toml explicitly includes all dependencies and no longer relies on the MDAnalysis dependency stack (PR #3)

1.0.0 -- 2023-10-10

The original MDAnalysis.analysis.psa was written by Sean Seyler in 2015 and had been part of MDAnalysis since release 0.10.0, https://docs.mdanalysis.org/2.6.1/documentation_pages/analysis/psa.html. Ian Kenney created the pathsimanalysis MDAKit in 2023, based on the original code in MDAnalysis. Additional contributors to the original source code are listed in the AUTHORS.md file.

Added

  • the core functionality of PathSimAnalysis (and its tests) was implemented using the source code from MDAnalysis.analysis.psa
  • PRs trigger Read the Docs for debugging documentation (PR #1)
  • GitHub actions workflow for building and deploying docs to GitHub pages (PR #2)