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sk Skill · Hello-QM

rdkit

Use RDKit for molecular conformer generation, SMILES/InChI handling, molecular descriptors, fingerprints, and substructure searching. Python-based toolkit.

installs 8w
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starts with the next reading
Related entries
6
Connections
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python
Host repository
Hello-QM/catgo-LRG
Compatible with
Requires RDKit Python package (conda install -c conda-forge rdkit or pip install rdkit).
Host stars
199