Quantum biochemical analysis of the binding interactions between a potential inhibitory drug and the Ebola viral glycoprotein.

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Title: Quantum biochemical analysis of the binding interactions between a potential inhibitory drug and the Ebola viral glycoprotein.
Authors: da Rocha JM; Department of Biophysics and Pharmacology, Bioscience Center, Federal University of Rio Grande do Norte, Natal, RN, Brazil., Campos DMO; Department of Biophysics and Pharmacology, Bioscience Center, Federal University of Rio Grande do Norte, Natal, RN, Brazil., Esmaile SC; Department of Biophysics and Pharmacology, Bioscience Center, Federal University of Rio Grande do Norte, Natal, RN, Brazil., Menezes GL; Department of Biophysics and Pharmacology, Bioscience Center, Federal University of Rio Grande do Norte, Natal, RN, Brazil., Bezerra KS; Department of Biophysics and Pharmacology, Bioscience Center, Federal University of Rio Grande do Norte, Natal, RN, Brazil., da Silva RA; Core Collaboratives of BioSistemas, Special Unit of Exact Sciences, Federal University of Jataí, Jataí, GO, Brazil., Junior EDDS; Department of Biophysics and Pharmacology, Bioscience Center, Federal University of Rio Grande do Norte, Natal, RN, Brazil., Tayyeb JZ; Department of Clinical Biochemistry, College of Medicine, University of Jeddah, Jeddah, Saudi Arabia., Akash S; Department of Pharmacy, Faculty of Allied Health Sciences, Daffodil International University, Birulia, Ashulia, Dhaka, Bangladesh., Fulco UL; Department of Biophysics and Pharmacology, Bioscience Center, Federal University of Rio Grande do Norte, Natal, RN, Brazil., Alqahtani T; Department of Pharmacology, College of Pharmacy, King Khalid University, Abha, Saudi Arabia., Oliveira JIN; Department of Biophysics and Pharmacology, Bioscience Center, Federal University of Rio Grande do Norte, Natal, RN, Brazil.
Source: Journal of biomolecular structure & dynamics [J Biomol Struct Dyn] 2025 Jun; Vol. 43 (9), pp. 4753-4769. Date of Electronic Publication: 2024 Jan 23.
Publication Type: Journal Article
Journal Info: Publisher: Taylor & Francis Country of Publication: England NLM ID: 8404176 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1538-0254 (Electronic) Linking ISSN: 07391102 NLM ISO Abbreviation: J Biomol Struct Dyn Subsets: MEDLINE
Database: MEDLINE Ultimate
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ISSN:1538-0254
DOI:10.1080/07391102.2024.2305314