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theochem

theochem/iodata

Python library for reading, writing, and converting computational chemistry file formats and generating input files.

18 Releases
Latest: 4mo ago
v1.0.1Latest
github-actions[bot]github-actions[bot]·4mo ago·February 3, 2026
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v1.0.0a8
github-actions[bot]github-actions[bot]·1y ago·June 5, 2025
GitHub
v1.0.0a5
github-actions[bot]github-actions[bot]·1y ago·September 18, 2024
GitHub
v1.0.0a4
github-actions[bot]github-actions[bot]·2y ago·June 18, 2024
GitHub
v1.0.0a3
github-actions[bot]github-actions[bot]·2y ago·June 5, 2024
GitHub
Automatic release of version 1.0.0a21.0.0a2Pre-release
github-actions[bot]github-actions[bot]·4y ago·July 6, 2021
GitHub
Automatic release of version 1.0.0a11.0.0a1Pre-release
theochem-ci-bottheochem-ci-bot·5y ago·August 16, 2020
GitHub
0.1.7
theochem-ci-bottheochem-ci-bot·7y ago·November 19, 2018
GitHub
0.1.7a1Pre-release
theochem-ci-bottheochem-ci-bot·7y ago·November 19, 2018
GitHub
0.1.6
theochem-ci-bottheochem-ci-bot·7y ago·September 19, 2018
GitHub
0.1.6a2Pre-release
theochem-ci-bottheochem-ci-bot·7y ago·September 19, 2018
GitHub
0.1.6a1Pre-release
theochem-ci-bottheochem-ci-bot·7y ago·September 18, 2018
GitHub
0.1.5
theochem-ci-bottheochem-ci-bot·7y ago·September 18, 2018
GitHub
0.1.5a2Pre-release
theochem-ci-bottheochem-ci-bot·7y ago·September 18, 2018
GitHub
0.1.5a1Pre-release
theochem-ci-bottheochem-ci-bot·7y ago·September 18, 2018
GitHub
0.1.3
theochem-ci-bottheochem-ci-bot·8y ago·November 11, 2017
GitHub
0.1.3a1Pre-release
theochem-ci-bottheochem-ci-bot·8y ago·November 10, 2017
GitHub
0.1.2
theochem-ci-bottheochem-ci-bot·8y ago·September 14, 2017
GitHub