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In silico exploration of aryl sulfonamide analogs as voltage-gated sodium channel 1.7 inhibitors by using 3D-QSAR, molecular docking study, and molecular dynamics simulations.

Mingxing WangYing WangDejiang KongHailun JiangJian WangMao-Sheng Cheng
Published in: Comput. Biol. Chem. (2018)
Keyphrases
  • molecular dynamics
  • molecular dynamics simulations
  • three dimensional
  • databases
  • scheduling problem