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Discovering new PI3Kα inhibitors with a strategy of combining ligand-based and structure-based virtual screening.

Miao YuQiong GuJun Xu
Published in: J. Comput. Aided Mol. Des. (2018)
Keyphrases
  • virtual screening
  • drug discovery
  • chemical structures
  • high throughput
  • similarity searching
  • scoring function
  • database
  • end users
  • early stage
  • binding sites