Molecular docking and dynamics studies for the identification of Nipah virus glycoprotein inhibitors from Indian medicinal plants.

Abhinand, Chandran S; Ibrahim, Junaida; Keshava Prasad, Thottethodi Subrahmanya; Raju, Rajesh; Oommen, Oommen V; Nair, Achuthsankar S

Abhinand, Chandran S; Ibrahim, Junaida; Keshava Prasad, Thottethodi Subrahmanya; Raju, Rajesh; Oommen, Oommen V; Nair, Achuthsankar S.

Afiliação

Abhinand CS; Department of Computational Biology and Bioinformatics, University of Kerala, Thiruvananthapuram, Kerala, India.
Ibrahim J; Center for Systems Biology and Molecular Medicine, Yenepoya Research Centre, Yenepoya (Deemed to be University), Mangalore, India.
Keshava Prasad TS; Department of Computational Biology and Bioinformatics, University of Kerala, Thiruvananthapuram, Kerala, India.
Raju R; Center for Systems Biology and Molecular Medicine, Yenepoya Research Centre, Yenepoya (Deemed to be University), Mangalore, India.
Oommen OV; Center for Systems Biology and Molecular Medicine, Yenepoya Research Centre, Yenepoya (Deemed to be University), Mangalore, India.
Nair AS; Center for Integrative Omics Data Science, Yenepoya (Deemed to be University), Mangalore, India.

J Biomol Struct Dyn ; 41(19): 9211-9218, 2023 11.

Article em En | MEDLINE | ID: mdl-36473711

Assuntos

Vírus Nipah; Plantas Medicinais; Humanos; Vírus Nipah/metabolismo; Simulação de Acoplamento Molecular; Ligantes; Glicoproteínas/química; Solventes; Simulação de Dinâmica Molecular

Palavras-chave

Nipah viral infection; Nipah viral therapeutics; phytocompounds; viral entry inhibitor; virtual screening

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Plantas Medicinais / Vírus Nipah Tipo de estudo: Diagnostic_studies / Prognostic_studies Limite: Humans Idioma: En Revista: J Biomol Struct Dyn Ano de publicação: 2023 Tipo de documento: Article

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