enhancements for the code and additional features#4
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AxelRolov wants to merge 12 commits into
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Ensembles v2
Refactor QSAR agent workflow contracts
Add Chemprop multi-task QSAR support
…ntation Prefer CheMeleon RDKit features for TabICL
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Testing
pre-commit run --all-filespassesuv run pytest tests/unit/ -vpasses