Recent Progress on Computer-Aided Inhibitor Design of H5N1 Influenza A Virus.
Design of novel H5N1 inhibitors is currently a research topic of vital importance owing to both a recent pandemic threat by the worldwide spread of H5N1 avian influenza and the high resistance of H5N1 virus to the most widely used commercial drug, oseltamivir-OTV (Tamiflu). There has been much progress in this field recently. This review covers recent work on bioinformatics studies, structure based design, computer modeling and molecular dynamics simulations.
Guo
Xiaoli
X
Wang
Jing-Fang
JF
Zhu
Yisheng
Y
Wei
Dong-Qing
DQ
Department of Bioinformatics and Biostatistics, College of Life Sciences and Biotechnology, Shanghai Jiaotong University, Room 4-321, Life Science Building, 800 Dongchuan Road, Minhang District, Shanghai, 200240, China. dqwei@sjtu.edu.cn.
D000818:Animals; D000998:Antiviral Agents / Q000737:chemistry*; D019295:Computational Biology; D017076:Computer-Aided Design; D015195:Drug Design; D006801:Humans; D053124:Influenza A Virus, H5N1 Subtype / Q000187:drug effects; D056004:Molecular Dynamics Simulation; D015394:Molecular Structure; D053139:Oseltamivir / Q000494:pharmacology
D000998:Antiviral Agents; D053139:Oseltamivir