From 10b503c9aee8ee6652084752f1757b56a6637675 Mon Sep 17 00:00:00 2001 From: Ian Kenney Date: Tue, 17 Oct 2023 14:49:02 -0700 Subject: [PATCH 1/2] Updated CHANGELOG --- CHANGELOG.md | 20 ++++++++++++++++++++ 1 file changed, 20 insertions(+) diff --git a/CHANGELOG.md b/CHANGELOG.md index 5041f92..04459b3 100644 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -20,9 +20,11 @@ The rules for this file: ### Authors +- ianmkenney ### Added +- GitHub action workflow for automatic PyPI package deployment (PR #3) ### Fixed @@ -35,3 +37,21 @@ The rules for this file: ### Removed + +## [1.0.0] -- 2023-10-10 + +pathsimanalysis was created by Ian Kenney in 2023 and is based upon the +source code in the MDAnalysis.analysis.psa analysis submodule originally +authored by Sean Seyler in 2015. Additional contributors to the original +source are reflected in the AUTHORS.md file contained in this repository. + +### 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) + +[Unreleased]: https://github.com/MDAnalysis/PathSimAnalysis/compare/1.0.0...HEAD +[1.0.0]: https://github.com/MDAnalysis/PathSimAnalysis/releases/tag/1.0.0 \ No newline at end of file From 111d23d30f4df6e09ef422873048f5c1c0c5a62f Mon Sep 17 00:00:00 2001 From: Ian Kenney Date: Wed, 18 Oct 2023 11:22:33 -0700 Subject: [PATCH 2/2] Updated CHANGELOG --- CHANGELOG.md | 10 ++++++---- 1 file changed, 6 insertions(+), 4 deletions(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index 04459b3..570e254 100644 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -40,10 +40,12 @@ The rules for this file: ## [1.0.0] -- 2023-10-10 -pathsimanalysis was created by Ian Kenney in 2023 and is based upon the -source code in the MDAnalysis.analysis.psa analysis submodule originally -authored by Sean Seyler in 2015. Additional contributors to the original -source are reflected in the AUTHORS.md file contained in this repository. +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