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Commits on Apr 21, 2024

• removing mols for upd

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Commits on Sep 11, 2023

• accidentally did not add pdbqt file. Corrected

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Commits on Jun 30, 2023

• Merge pull request #8 from aspuru-guzik-group/chore/update-docs

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Commits on Jun 24, 2023

• Merge pull request #7 from aspuru-guzik-group/feature/neurips-updates

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Commits on Mar 31, 2023

• docking jupyter notebook updated

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Commits on Mar 30, 2023

• updated best molecules notebook

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• jupyter notebook update

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Commits on Mar 6, 2023

• Merge pull request #4 from aspuru-guzik-group/feature/docs-enhancement

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Commits on Mar 3, 2023

• Merge pull request #3 from jwilles/feature/packaging

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Commits on Oct 22, 2022

• Update README.md

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Commits on Sep 27, 2022

• Update README.md

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• Update README.md

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• Update README.md

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Commits on Sep 26, 2022

• Update README.md

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• Update README.md

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Commits on Aug 14, 2022

• upd

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• updated dataset with properties.

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Commits on Jul 31, 2022

• added PCE

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Commits on Jul 30, 2022

• Update README.md

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Commits on Jul 29, 2022

• tadf

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• catal add

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• docking results added

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• hce added

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Commits on Jul 26, 2022

• Update README.md

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Commits on Jul 25, 2022

• Update README.md

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Commits on Jul 24, 2022

• Update README.md

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Commits on Jul 7, 2022

• Update README.md

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Commits on Feb 3, 2022

• Update README.md

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• Update README.md

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