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Merge pull request #48 from mikemhenry/add-conda-install
scikit_mol ci #148: Commit 32c7d50 pushed by EBjerrum
September 28, 2024 08:24 9m 32s main
September 28, 2024 08:24 9m 32s
add conda install steps
scikit_mol ci #147: Pull request #48 opened by mikemhenry
September 26, 2024 22:08 9m 40s mikemhenry:add-conda-install
September 26, 2024 22:08 9m 40s
Merge pull request #42 from c-feldmann/handle_invalid_molecules
scikit_mol ci #146: Commit e076a1c pushed by EBjerrum
September 17, 2024 08:34 4m 1s handle_invalid_molecules
September 17, 2024 08:34 4m 1s
Updated wrong info in setup.cfg
scikit_mol ci #145: Commit 17ef6d1 pushed by EBjerrum
September 17, 2024 08:31 10m 23s handle_invalid_molecules
September 17, 2024 08:31 10m 23s
Handle invalid molecules
scikit_mol ci #141: Pull request #42 synchronize by c-feldmann
September 13, 2024 09:57 3m 10s c-feldmann:handle_invalid_molecules
September 13, 2024 09:57 3m 10s
Updated wrong info in setup.cfg
scikit_mol ci #139: Commit 17ef6d1 pushed by EBjerrum
April 26, 2024 09:47 6m 47s main
April 26, 2024 09:47 6m 47s
scikit_mol ci
scikit_mol ci #138: by EBjerrum
April 26, 2024 09:46 8m 1s v0.3.1
April 26, 2024 09:46 8m 1s
Updated readmes with notebooks
scikit_mol ci #137: Commit a10998f pushed by EBjerrum
April 12, 2024 12:32 8m 47s v0.3.0
April 12, 2024 12:32 8m 47s
Updated readmes with notebooks
scikit_mol ci #136: Commit a10998f pushed by EBjerrum
April 12, 2024 12:29 7m 38s main
April 12, 2024 12:29 7m 38s
Merge pull request #40 from enricogandini/pandas_output
scikit_mol ci #135: Commit 179aab6 pushed by EBjerrum
April 12, 2024 11:57 8m 1s pandas_output
April 12, 2024 11:57 8m 1s
Changed License after consents from co-authors. A single file was lef…
scikit_mol ci #134: Commit 182fde4 pushed by EBjerrum
April 12, 2024 11:51 3m 21s main
April 12, 2024 11:51 3m 21s
chore: correct cddd sample file and notebook
scikit_mol ci #133: Pull request #40 synchronize by enricogandini
March 20, 2024 07:31 7m 28s enricogandini:pandas_output
March 20, 2024 07:31 7m 28s
chore: correct cddd sample file and notebook
scikit_mol ci #132: Pull request #40 synchronize by enricogandini
March 19, 2024 12:57 7m 34s enricogandini:pandas_output
March 19, 2024 12:57 7m 34s
Fixed a bug in a deprecated import
scikit_mol ci #131: Commit 2973f70 pushed by EBjerrum
March 18, 2024 13:43 7m 8s pandas_output
March 18, 2024 13:43 7m 8s
Merge branch 'pandas_output' of github.com:EBjerrum/scikit-mol into p…
scikit_mol ci #130: Commit c6c1003 pushed by EBjerrum
March 18, 2024 13:23 9m 31s pandas_output
March 18, 2024 13:23 9m 31s
Merge pull request #39 from enricogandini/pandas_output
scikit_mol ci #129: Commit 077c022 pushed by EBjerrum
March 18, 2024 13:21 7m 50s pandas_output
March 18, 2024 13:21 7m 50s
Update README.md
scikit_mol ci #128: Commit 51186c4 pushed by EBjerrum
March 15, 2024 17:17 3m 34s main
March 15, 2024 17:17 3m 34s
Pandas output
scikit_mol ci #127: Pull request #39 synchronize by enricogandini
March 10, 2024 21:59 9m 37s enricogandini:pandas_output
March 10, 2024 21:59 9m 37s
Some presumably now unneeded reshapes?
scikit_mol ci #114: Commit ba3d190 pushed by EBjerrum
March 7, 2024 09:14 3m 34s pandas_output
March 7, 2024 09:14 3m 34s
Update README.md
scikit_mol ci #107: Commit 395c757 pushed by EBjerrum
December 22, 2023 07:56 3m 18s main
December 22, 2023 07:56 3m 18s
Merge branch 'main' into citation
scikit_mol ci #106: Commit 0f35eae pushed by EBjerrum
December 20, 2023 10:08 3m 27s main
December 20, 2023 10:08 3m 27s
Merge pull request #36 from EBjerrum/contribution
scikit_mol ci #105: Commit 83f0401 pushed by EBjerrum
September 22, 2023 17:15 3m 49s main
September 22, 2023 17:15 3m 49s