rdkit
Cheminformatics toolkit for fine-grained molecular control. SMILES/SDF parsing, descriptors (MW, LogP, TPSA), fingerprints, substructure search, 2D/3D generation, similarity, reactions. For standard workflows with simpler interface, use datamol (wrapper around RDKit). Use rdkit for advanced control, custom sanitization, specialized algorithms.
81
1.38x
Quality
75%
Does it follow best practices?
Impact
93%
1.38xAverage score across 3 eval scenarios
Securityby
Passed
No known issues
Optimize this skill with Tessl
npx tessl skill review --optimize ./scientific-skills/rdkit/SKILL.mdNo security issues found
Scanned
- Repository
- K-Dense-AI/claude-scientific-skills
- Commit
086de41
- Audited
- Security analysis
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