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Discovery of a nanomolar inhibitor of the human glyoxalase-I enzyme using structure-based poly-pharmacophore modelling and molecular docking.

Nizar A. Al-Shar'iQosay A. E. Al-BalasRand A. Al-WaqfiMohammad A. HassanAmer E. AlkhalifaNehad M. Ayoub
Published in: J. Comput. Aided Mol. Des. (2019)
Keyphrases
  • drug discovery
  • knowledge discovery
  • structural information
  • discovery process
  • three dimensional
  • data structure
  • hiv protease
  • genetic algorithm
  • human computer interaction
  • human behavior