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Commits : Listings

Analyzed about 1 year ago. based on code collected over 4 years ago.
Sep 24, 2019 — Sep 24, 2020
Commit Message Contributor Files Modified Lines Added Lines Removed Code Location Date
Switch to using sire.legacy.Units throughout. More... about 2 years ago
Using sire legacy More... about 2 years ago
Doc formatting More... about 2 years ago
Typos. More... about 2 years ago
Autoformat docstrings. More... about 2 years ago
Merge remote-tracking branch 'michellab/feature-2023_0' into feature_merge_sire_2023 More... about 2 years ago
Fixed a typo More... about 2 years ago
Merge branch 'michellab-devel' into feature_merge_sire_2023 More... about 2 years ago
Fix GPLv3 links. [ci skip] More... about 2 years ago
Fix GPLv3 link. [ci skip] More... about 2 years ago
Merge pull request #422 from michellab/bugfix-restraints More... about 2 years ago
restructured positional restraints code to remove use of exception handling More... about 2 years ago
Update license in source header. More... about 2 years ago
bugfix to make the position restraints code compatible with newer python versions More... about 2 years ago
Exscientia sandpit requires alchemlyb < 2 (for AutoMBAR). More... about 2 years ago
Exscientia sandpit currently requires alchemlyb < 2 (for AutoMBAR.) More... about 2 years ago
Need show_warnings option in readPDB function too. More... about 2 years ago
Only run formatting (black) tests on Linux. More... about 2 years ago
Expose show_warnings option in readMolecules. More... about 2 years ago
Entirely disable messages with show_warnings=False. More... about 2 years ago
Fix BioSimSpace requirements. More... about 2 years ago
Fix source_files path in formatting test. More... about 2 years ago
Run pytest --black as part of conda recipe test stage. More... about 2 years ago
Update license in conda recipe. More... about 2 years ago
Update license in conda recipe. More... about 2 years ago
Fix build badge link. [ci skip] More... about 2 years ago
Update to GPLv3 license. More... about 2 years ago
Revert status badge links. [ci skip] More... about 2 years ago
Use default conda root. More... about 2 years ago
Upload packages from the default conda-bld directory. More... about 2 years ago