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Novel phosphatidylinositol 4-kinases III beta (PI4KIIIβ) inhibitors discovered by virtual screening using free energy models.

Natalie M. ColodetteLucas S. FrancoRodolfo C. MaiaHarold H. FokoueCarlos Mauricio R. Sant'AnnaEliezer J. Barreiro
Published in: J. Comput. Aided Mol. Des. (2020)
Keyphrases
  • free energy
  • complex systems
  • probabilistic model
  • feature selection
  • similarity measure
  • graphical models
  • model selection
  • parameter estimation
  • fixed point
  • competitive learning