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RanDepict documentation
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Contents:

  • RanDepict
    • RanDepict package
  • Depict chemical structures with CDK, RDKit, Indigo or PIKAChU
  • Depict chemical structures with a random toolkit
  • Create random depictions with random augmentations
  • Create random depictions with cxSMILES with coordinates
  • Create random hand-drawn like depictions
  • Create and save a batch of images
  • Create a batch of images while ensuring diversity using feature fingerprints
  • Create and save a batch of images while ensuring diversity using feature fingerprints
  • Artificial generation of SMILES that represent markush structures
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