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sk Skill · SpectrAI-Initiative

molecular_fingerprint_analysis

Molecular Fingerprint Analysis — Fingerprint analysis: topology descriptors, structure complexity, similarity calculation, and AromaticityAnalysis. Use this skill for cheminformatics tasks involving calculate mol topology calculate mol structure complexity calculate smiles similarity AromaticityAnalyzer. Combines 4 tools from 2 SCP server(s).

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pythonjsonTypeScript
Host repository
SpectrAI-Initiative/InnoClaw
Host stars
394
Host language
TypeScript