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        Integrating molecular modelling methods to advance influenza A virus drug discovery

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        AuthorsManuscript.pdf (PDF, 2Mb)(embargoed until 19/11/2021)
        Author
        Patel, Hershna
        Kukol, Andreas
        Attention
        2299/23518
        Abstract
        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.
        Publication date
        2020-11-19
        Published in
        Drug Discovery Today
        Published version
        https://doi.org/10.1016/j.drudis.2020.11.014
        Other links
        http://hdl.handle.net/2299/23518
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