TY - JOUR
T1 - Integrating molecular modelling methods to advance influenza A virus drug discovery
AU - Patel, Hershna
AU - Kukol, Andreas
PY - 2020/11/19
Y1 - 2020/11/19
N2 - Since the discovery of the anti-influenza drugs Oseltamivir and Zanamivir using computer aided drug design methods, there have been significant applications of molecular modelling methodologies applied to influenza A virus drug discovery, such as molecular dynamics simulation, molecular docking and virtual screening. This review provides a brief general introduction to molecular modelling in the context of drug discovery and then focuses on the advances and impact of integrating these methods with specific reference to potential influenza A antiviral drug targets.
AB - Since the discovery of the anti-influenza drugs Oseltamivir and Zanamivir using computer aided drug design methods, there have been significant applications of molecular modelling methodologies applied to influenza A virus drug discovery, such as molecular dynamics simulation, molecular docking and virtual screening. This review provides a brief general introduction to molecular modelling in the context of drug discovery and then focuses on the advances and impact of integrating these methods with specific reference to potential influenza A antiviral drug targets.
U2 - 10.1016/j.drudis.2020.11.014
DO - 10.1016/j.drudis.2020.11.014
M3 - Article
SN - 1359-6446
JO - Drug Discovery Today
JF - Drug Discovery Today
ER -