DeepMol

github.com/biosystemsum/deepmol
Active178updated 3 months ago
Python
BSD-2-Clause

Unified ML/DL framework for drug discovery workflows, integrating RDKit, DeepChem, and scikit-learn with SHAP explainability

Sourced from

  • GitHubgithub.com/biosystemsum/deepmol
  • Awesome AI for Sciencegithub.com/biosystemsum/deepmol

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