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OpenClaw Skills & Use Case Index

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Skills tagged: chemical informatics

Browse skills that share this tag.

  • 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
  • matchms - Mass spectrometry data analysis library
    mass spectrometrymetabolomicsspectral analysischemical informatics

    ★ 1 · Updated 2026-03-22

    Process and analyze mass spectrometry data with spectral filtering, similarity calculations, and metadata harmonization

    ⚙ load spectra⚙ save spectra⚙ normalize intensities