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Bridging the gap between chemical reaction pretraining and conditional molecule generation with a unified model.

Bo QiangYiran ZhouYuheng DingNingfeng LiuSong SongLiangren ZhangBo HuangZhenming Liu
Published in: Nat. Mac. Intell. (2023)
Keyphrases
  • unified model
  • chemical reaction
  • chemical reactions
  • generation process
  • database
  • cooperative
  • data sets
  • search engine
  • computer vision
  • natural language
  • probabilistic model