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Comprehensive assessment of deep generative architectures for de novo drug design.

Mingyang WangHuiyong SunJike WangJinping PangXin ChaiLei XuHonglin LiDongsheng CaoTingjun Hou
Published in: Briefings Bioinform. (2022)
Keyphrases
  • drug design
  • protein protein interactions
  • protein structure prediction
  • drug discovery
  • quantitative structure activity
  • machine learning
  • pairwise
  • high accuracy
  • monitoring system
  • sequence data
  • mass spectrometry