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MACAW: An Accessible Tool for Molecular Embedding and Inverse Molecular Design.

Vincent BlayTijana RadivojevicJonathan E. AllenCorey M. HudsonHéctor García Martín
Published in: J. Chem. Inf. Model. (2022)
Keyphrases
  • engineering design
  • molecular dynamics
  • design process
  • case study
  • user interface
  • design tools
  • data sets
  • neural network
  • three dimensional
  • building blocks
  • software tools
  • sequence analysis
  • dna computing