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OpenClaw Skills & Use Case Index

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Skills tagged: drug discovery

Browse skills that share this tag.

  • pdb-database - Access RCSB PDB 3D Protein & Nucleic Acid Structures
    PDBstructural biologyprotein structuresdrug discovery

    ★ 650 · Updated 2026-06-30

    Search, retrieve, and download 3D biological macromolecule structures and metadata from RCSB PDB for structural biology and drug discovery.

    ⚙ Search structures by text⚙ Search structures by attributes⚙ Search by sequence similarity
  • pdb-database - Access RCSB PDB 3D Protein and Nucleic Acid Structures
    PDB databaseprotein structurestructural biologyRCSB PDB

    ★ 65 · Updated 2026-06-30

    Search, retrieve, and download 3D biological macromolecular structures and metadata from the RCSB PDB repository via text, sequence, or structural similarity queries.

    ⚙ search PDB structures by text⚙ search PDB by sequence similarity⚙ search PDB by structural similarity
  • 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
  • tooluniverse - Unified access to 600+ scientific research tools
    scientific toolsbioinformaticscheminformaticsdrug discovery

    ★ 22 · Updated 2026-06-30

    Provides standardized access to 600+ scientific tools across bioinformatics, cheminformatics, genomics, structural biology, proteomics, and drug discovery.

    ⚙ Discover scientific tools by search⚙ Execute scientific tools via protocol⚙ Compose multi-step research workflows
  • medchem - Medicinal Chemistry Filtering Library
    drug discoverymedicinal chemistrymolecular filteringcompound libraries

    ★ 650 · Updated 2026-06-30

    Apply drug-likeness rules, PAINS filters, structural alerts, and complexity metrics for compound filtering and prioritization.

    ⚙ apply drug-likeness rules⚙ filter molecules⚙ detect structural alerts
  • tooluniverse - Scientific Research Tools and Workflows
    bioinformaticscheminformaticsgenomicsdrug discovery

    ★ 2 · Updated 2026-06-30

    Discover, execute, and compose 600+ scientific tools across bioinformatics, cheminformatics, genomics, and drug discovery domains.

    ⚙ discover scientific tools⚙ execute scientific tools⚙ compose multi-step workflows
  • chembl-database - Query ChEMBL bioactive molecules database
    chemistrydrug discoverybioinformaticsdatabase

    ★ 428 · Updated 2026-06-30

    Programmatically query ChEMBL database for compounds, targets, bioactivity data, and drug information

    ⚙ retrieve molecule⚙ search molecules⚙ filter molecules
  • tooluniverse - Access 600+ Scientific Research Tools
    bioinformaticsgenomicsdrug discoveryscientific tools

    ★ 399 · Updated 2026-06-30

    Discover, execute, and compose 600+ scientific tools for bioinformatics, genomics, and drug discovery research

    ⚙ discover tools⚙ execute tools⚙ compose workflows
  • chembl-database - ChEMBL Drug Discovery Data
    drug discoverymedicinal chemistrybioactivitycheminformatics

    ★ 0 · Updated 2026-06-30

    Query ChEMBL's bioactive molecules and drug discovery data

    ⚙ search compounds⚙ retrieve bioactivity data⚙ find inhibitors
  • chembl-database - Query ChEMBL Bioactive Molecule Database
    bioinformaticsdrug discoverymedicinal chemistrychemical database

    ★ 0 · Updated 2026-06-30

    Query bioactive molecules, compounds, and drug discovery data from ChEMBL database

    ⚙ search molecules⚙ filter molecules⚙ search similar compounds
  • chembl-database - Query ChEMBL bioactive molecules database
    drug discoverymedicinal chemistrybioactivity datacompound search

    ★ 31,836 · Updated 2026-06-30

    Query ChEMBL's bioactive molecules and drug discovery data programmatically

    ⚙ get molecule by ID⚙ search molecule by name⚙ filter molecule by properties
  • biomni - Autonomous Biomedical AI Agent Framework
    genomicsdrug discoverymolecular biologyclinical analysis

    ★ 399 · Updated 2026-06-15

    Autonomous biomedical AI agent framework for executing complex research tasks across genomics, drug discovery, and clinical analysis

    ⚙ Design CRISPR screens⚙ Analyze single-cell RNA-seq⚙ Predict ADMET properties
  • biomni - Biomedical AI Research Agent Framework
    biomedicalAI agentgenomicsdrug discovery

    ★ 428 · Updated 2026-06-15

    Autonomous AI framework for biomedical research tasks including genomics, drug discovery, and clinical analysis

    ⚙ decompose biomedical tasks⚙ generate analysis code⚙ execute analysis pipelines
  • biomni - Biomedical AI Agent Framework
    biomedicalgenomicsdrug discoverymolecular biology

    ★ 650 · Updated 2026-06-15

    Autonomous biomedical AI agent for genomics, drug discovery, molecular biology, and clinical analysis tasks

    ⚙ execute biomedical queries⚙ decompose research tasks⚙ retrieve biomedical knowledge
  • bio-reaction-enumeration - Chemical Library Enumeration via Reaction SMARTS
    combinatorial chemistrychemical synthesisdrug discoverylibrary enumeration

    ★ 0 · Updated 2026-03-25

    Enumerates virtual compound libraries from building blocks using reaction SMARTS transformations

    ⚙ define reaction SMARTS⚙ validate reaction definitions⚙ run chemical reactions
  • bio-reaction-enumeration - Enumerate Chemical Reaction Libraries
    chemical informaticsdrug discoverycombinatorial chemistrychemical libraries

    ★ 2 · Updated 2026-03-25

    Enumerates chemical libraries using RDKit reaction SMARTS transformations

    ⚙ enumerate reaction products⚙ generate virtual compounds⚙ validate products
  • bio-reaction-enumeration - Chemical Reaction Enumeration with RDKit
    chemistryreaction enumerationcombinatorial chemistryRDKit

    ★ 359 · Updated 2026-03-25

    Enumerates chemical libraries through reaction SMARTS transformations using RDKit

    ⚙ Define reaction SMARTS⚙ Validate reaction definitions⚙ Run chemical reactions
  • drugflow-skills - DrugFlow API workflow automation
    API workflowvirtual screeningmolecular dockingADMET prediction

    ★ 816 · Updated 2026-03-23

    Multi-flow API workflow executor for DrugFlow Django repository

    ⚙ signin⚙ signup⚙ list workspaces