Insights into the binding mode of new N-substituted pyrazoline derivatives to MAO-A: docking and quantum chemical calculations


Erdem S. S. , Turkkan S., YELEKÇİ K., GÖKHAN KELEKÇİ N.

JOURNAL OF NEURAL TRANSMISSION, vol.120, no.6, pp.859-862, 2013 (Journal Indexed in SCI) identifier identifier identifier

  • Publication Type: Article / Article
  • Volume: 120 Issue: 6
  • Publication Date: 2013
  • Doi Number: 10.1007/s00702-012-0950-4
  • Title of Journal : JOURNAL OF NEURAL TRANSMISSION
  • Page Numbers: pp.859-862

Abstract

The binding modes of four N-substituted pyrazoline derivatives as novel MAO-A inhibitory agents were investigated using docking and quantum chemical molecular modelling tools.