From 228a7a914fb7b2ecd31047f610ee69dfa596c2d7 Mon Sep 17 00:00:00 2001 From: Colton Hicks Date: Fri, 26 Jul 2024 15:34:16 -0700 Subject: [PATCH] Bumped version to 0.11.6. Updated CHANGELOG. --- CHANGELOG.md | 5 ++++- pyproject.toml | 2 +- 2 files changed, 5 insertions(+), 2 deletions(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index cee2571..ba6c492 100644 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -6,6 +6,8 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), ## [unreleased] +## [0.11.6] - 2024-07-26 + ### Added - `Structures.to_smiles` now correctly adds charge information the the SMILES using `rdkit` or `openbabel`. @@ -390,7 +392,8 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), - `SinglePointComputedProperties` - `Wavefunction` -[unreleased]: https://github.com/coltonbh/qcio/compare/0.11.5...HEAD +[unreleased]: https://github.com/coltonbh/qcio/compare/0.11.6...HEAD +[0.11.6]: https://github.com/coltonbh/qcio/releases/tag/0.11.6 [0.11.5]: https://github.com/coltonbh/qcio/releases/tag/0.11.5 [0.11.4]: https://github.com/coltonbh/qcio/releases/tag/0.11.4 [0.11.3]: https://github.com/coltonbh/qcio/releases/tag/0.11.3 diff --git a/pyproject.toml b/pyproject.toml index 05de0f7..c42d3ad 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -4,7 +4,7 @@ build-backend = "poetry.core.masonry.api" [tool.poetry] name = "qcio" -version = "0.11.5" +version = "0.11.6" description = "Beautiful and user friendly data structures for quantum chemistry." authors = ["Colton Hicks "] license = "MIT"