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sandres

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sandres

azevedolab / sandres

Statistical Analysis of Docking Results and Scoring functions

python machine-learning scikit-learn docking protein-ligand-interactions sandres scoring-function-space

Updated Jan 28, 2026
Python

azevedolab / Docking

Docking Screens for Drug Discovery (2nd Edition)

python machine-learning scikit-learn docking protein-ligand-interactions sandres scoring-function-space taba

Updated Jan 15, 2026
Jupyter Notebook

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