Commits

History for

Commits on Sep 28, 2024

Fix scoring bug, and tests (#65 )

authoredSep 28, 2024

Commits on Sep 25, 2024

Make Robust Loader (#59 )

authoredSep 25, 2024

Commits on Sep 21, 2024

Add split to query_index (#63 )

Ninjani
and
tjduigna
authoredSep 21, 2024

Commits on Sep 20, 2024

Refactoring eval for better usability (#62 )
Ninjani
authoredSep 20, 2024

Commits on Sep 19, 2024

Autodocs, index cleanup, linked scores bug fixes, linked structures optimizations (#53 )

authoredSep 19, 2024

Commits on Sep 5, 2024

Add a sample notebook to load training and validation data (#42 )

authoredSep 5, 2024

Commits on Sep 3, 2024

Cleanup dependencies (#51 )

yusuf1759
and
tjduigna
authoredSep 3, 2024
Plinder system performance improvements (#39 )
tjduigna
authoredSep 3, 2024

Commits on Aug 29, 2024

Add unit testing to eval code (#38 )

yusuf1759
and
tjduigna
authoredAug 29, 2024
Update splitting (#28 )

authoredAug 29, 2024

Commits on Aug 26, 2024

Fix pred linked structure generation (#26 )
tjduigna
authoredAug 26, 2024

Commits on Aug 16, 2024

Plinder Data Loader (#15 )
tjduigna
authoredAug 16, 2024

Commits on Aug 7, 2024

fix covalent detection, comment out unused code (#18 )

OleinikovasV
and
Ninjani
authoredAug 7, 2024

Commits on Aug 5, 2024

feat: change system and interaction definition (#17 )
Ninjani
authoredAug 5, 2024

Commits on Jul 29, 2024

Annotation updates (#14 )

Ninjani
and
OleinikovasV
authoredJul 29, 2024

Commits on Jul 17, 2024

Add licence headers (#1 )
tjduigna
authoredJul 17, 2024
feat: naive migration from organization repo bumpversion skip
tjduigna
committedJul 17, 2024

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