From 7705bd3e7fc96765174f3ceeaf9286ad09ca2f7c Mon Sep 17 00:00:00 2001 From: Colton Hicks Date: Thu, 29 Jun 2023 20:19:14 -0700 Subject: [PATCH] Updated package description. Released 0.3.2 --- CHANGELOG.md | 9 ++++++++- pyproject.toml | 4 ++-- 2 files changed, 10 insertions(+), 3 deletions(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index 5cb4d0f..bc85ae2 100644 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -8,6 +8,12 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), ## [0.3.1] +### Fixed + +- Updated package description in pyproject.toml from TeraChem specific parsing and MolSSI to all QC packages and qcio. + +## [0.3.1] + ### Added - Git commit parsing for TeraChem as part of version parsing @@ -48,7 +54,8 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), - Can return either `AtomicResult` or `FailedOperation` objects depending on whether calculation succeeded or failed. - Tests for all parsers and the main `parse` function. -[unreleased]: https://github.com/coltonbh/qcparse/compare/0.3.1...HEAD +[unreleased]: https://github.com/coltonbh/qcparse/compare/0.3.2...HEAD +[0.3.2]: https://github.com/coltonbh/qcparse/releases/tag/0.3.2 [0.3.1]: https://github.com/coltonbh/qcparse/releases/tag/0.3.1 [0.3.0]: https://github.com/coltonbh/qcparse/releases/tag/0.3.0 [0.2.1]: https://github.com/coltonbh/qcparse/releases/tag/0.2.1 diff --git a/pyproject.toml b/pyproject.toml index ded029d..0f0fa99 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -1,7 +1,7 @@ [tool.poetry] name = "qcparse" -version = "0.3.1" -description = "A package for parsing TeraChem file outputs into structured MolSSI data objects." +version = "0.3.2" +description = "A package for parsing Quantum Chemistry program file outputs into structured qcio data objects." authors = ["Colton Hicks "] license = "MIT" readme = "README.md"