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1. MolecularAI/uq4dd MolecularAI/uq4dd Public

   UQ4DD: Uncertainty Quantification for Drug Discovery

   Python 17 2

2. CalibrationStudy CalibrationStudy Public

   Python 3 3

3. melloddy/SparseChem melloddy/SparseChem Public

   Fast and accurate machine learning models for biochemical applications.

   Python 59 12