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github.comtool

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Cheminformatics
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2026-10-10
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similar

  1. eiR github.com
  2. datamol github.com
  3. ChemPy github.com
  4. ChemML github.com
  5. OpenChem github.com
  6. Python for chemoinformatics github.com

Cheminformatics › Libraries > General Purpose: “Universal molecular toolkit that can be used for molecular fingerprinting, substructure search, and molecular visualization written in C++ package, with Java, C#, and Python wrappers.”