fragment_molecules_with_brics

Fragment a set of molecules with RDKit.

Name		Name	Last commit message	Last commit date
Latest commit History 7 Commits
imgs		imgs
README.md		README.md
drugbank_approved_experimental_investigational_scaffolds.csv		drugbank_approved_experimental_investigational_scaffolds.csv
drugbank_approved_structures.sdf		drugbank_approved_structures.sdf
drugbank_experimental_structures.sdf		drugbank_experimental_structures.sdf
drugbank_investigational_structures.sdf		drugbank_investigational_structures.sdf
fragment_molecule_with_brics.ipynb		fragment_molecule_with_brics.ipynb
fragment_molecule_with_brics.py		fragment_molecule_with_brics.py

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