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Graph and Geometry Generative Modeling for Drug Discovery.

Minkai XuMeng LiuWengong JinShuiwang JiJure LeskovecStefano Ermon
Published in: KDD (2023)
Keyphrases
  • drug discovery
  • chemical compounds
  • random walk
  • pharmaceutical industry
  • early stage
  • biological systems
  • knowledge discovery
  • high throughput
  • systems biology
  • virtual screening