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LiGen: A High Performance Workflow for Chemistry Driven de Novo Design.

Andrea BeccariCarlo CavazzoniClaudia BeatoGabriele Costantino
Published in: J. Chem. Inf. Model. (2013)
Keyphrases
  • engineering design
  • databases
  • user interface
  • data driven
  • building blocks
  • similarity search
  • software architecture
  • design decisions