Computational screening of known broad-spectrum antiviral small organic molecules for potential influenza HA stem inhibitors

With the emergence of new influenza virus strains that are resistant to current inhibitors such as oseltamivir (anti-neuraminidase (NA)) and amantadine (anti-M2 proton channel), influenza A viruses continue to be a serious threat to the public health worldwide. With this in view, there is a persiste...

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Veröffentlicht in:	PloS one 2018-09, Vol.13 (9), p.e0203148-e0203148
Hauptverfasser:	Mathew, Shilu, Al Thani, Asmaa A, Yassine, Hadi M
Format:	Artikel
Sprache:	eng
Schlagworte:	Amantadine Antibodies Antiviral activity Antiviral agents Antiviral Agents - chemistry Antiviral Agents - pharmacology Antiviral drugs Arsenic Avian flu Binding Bioassays Biology and life sciences Biomedical research Cancer therapies Care and treatment Computation Computer applications Computer Simulation Crystal structure Crystallography Design modifications Drug discovery Drug Discovery - methods Drugs Epitopes Exo-a-sialidase Flavonoids Flavonoids - antagonists & inhibitors Flavonoids - metabolism Health risks Health sciences Hemagglutinin Glycoproteins, Influenza Virus - metabolism Hemagglutinins Hydrogen Bonding Immunoglobulins Influenza Influenza A Influenza A virus Influenza vaccines Influenza viruses Inhibitors Medical research Medicine and Health Sciences Models, Molecular Molecular docking Nanoparticles Nanotechnology Neutralizing Organic chemistry Oseltamivir Pharmaceuticals Physical Sciences Public health Respiratory tract infections Risk factors Screening Sorbitol Structure-Activity Relationship Structure-activity relationships Vaccines Viruses
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