Computational discovery of SARS-CoV-2 viral entry inhibitory peptides from Androctonus mauretanicus scorpion venom: molecular docking and molecular dynamics simulations targeting the spike protein

Background and ObjectiveWhile vaccination remains central to controlling the COVID-19 pandemic, the emergence of SARS-CoV-2 variants with partial resistance to immune responses has highlighted the need for complementary therapeutic strategies. Among these, antiviral agents that inhibit viral entry m...

Ausführliche Beschreibung

Bibliografische Detailangaben

Hauptverfasser:	Reda Chahir, Salaheddine Redouane, Jacob Galan, Hicham Hboub, Lahoussaine Aserrar, Salma Chakir, Ahmed Salim Lahlou, Hinde Aassila, Rachid El Fatimy, Naoual Oukkache
Format:	Artigo
Sprache:	Inglês
Veröffentlicht:	Frontiers Media S.A. 2026-03-01
Schriftenreihe:	Frontiers in Bioinformatics
Schlagworte:	Androctonus mauretanicus antiviral agents COVID-19 molecular docking molecular dynamics SARS-CoV-2
Online-Zugang:	https://www.frontiersin.org/articles/10.3389/fbinf.2026.1677524/full
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