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2024
Molecular mechanism of rhinovirus escape from the Pyrazolo[3,4-d]pyrimidine capsid-binding inhibitor OBR-5-340 via mutations distant from the binding pocket: Derivatives that brake resistance
Antiviral Research
2024
Polyphenol rich sugarcane extract (PRSE) has potential antiviral activity against influenza A virus in vitro
Virology
2024
Elucidation of bezlotoxumab binding specificity to toxin B in Clostridioides difficile
Journal of Biomolecular Structure and Dynamics
2023
N‐glycosylation induced changes in tau protein dynamics reveal its role in tau misfolding and aggregation: A microsecond long molecular dynamics study
Proteins: Structure, Function, and Bioinformatics
2022
Frequency and distribution of H1N1 influenza A viruses with oseltamivir‐resistant mutations worldwide before and after the 2009 pandemic
Journal of Medical Virology
2022
Iterative Optimization and Structure–Activity Relationship Studies of Oseltamivir Amino Derivatives as Potent and Selective Neuraminidase Inhibitors via Targeting 150-Cavity
Journal of Medicinal Chemistry
2021
Identification of C5-NH2 Modified Oseltamivir Derivatives as Novel Influenza Neuraminidase Inhibitors with Highly Improved Antiviral Activities and Favorable Druggability
Journal of Medicinal Chemistry
2021
Theoretical insights into the molecular mechanism of I117V mutation in neuraminidase mediated reduction of oseltamivir drug susceptibility in A/H5N1 influenza virus
PeerJ Physical Chemistry