Virtual Screening with Generative Topographic Maps: How Many Maps Are Required?

Iuri CasciucYuliana ZabolotnaDragos HorvathGilles MarcouJürgen BajorathAlexandre Varnek
Published in: J. Chem. Inf. Model. (2019)
Keyphrases
  • topographic maps
  • virtual screening
  • geometric objects
  • contour lines
  • chemical structures
  • similarity searching
  • drug discovery
  • feature extraction
  • similarity search