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OpenClaw Skills & Use Case Index

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Skills with capability: Generate molecular fingerprints

Browse skills that share this capability.

  • molfeat - Convert molecular structures into ML features
    molecular featurizationcheminformaticsmolecular machine learningQSAR

    ★ 242 · Updated 2026-10-01

    Converts SMILES strings or RDKit molecules into fingerprints, descriptors, and pretrained embeddings for molecular machine learning.

    ⚙ Generate molecular fingerprints⚙ Calculate molecular descriptors⚙ Extract pretrained embeddings
  • drugbank-database - Access and Analyze DrugBank Database Drug Information
    DrugBankdrug discoverypharmacologydrug-drug interactions

    ★ 0 · Updated 2026-06-30

    Programmatically access DrugBank data to query drug properties, interactions, targets, pathways, chemical structures, and pharmacology for drug discovery research.

    ⚙ Download and parse DrugBank XML data⚙ Search drugs by ID name CAS number⚙ Extract drug chemical properties and structures
  • drugbank-database - DrugBank Database Access Tool
    pharmaceuticaldrug-databasedrug-interactionschemical-analysis

    ★ 68 · Updated 2026-06-30

    Access and analyze comprehensive drug information including properties, interactions, targets, and pathways

    ⚙ Download DrugBank data⚙ Parse XML data⚙ Search drugs by ID