Quantum–Chemical Multiligand Simultaneous Docking of Three-Membered Rings in the Active Site of Butyrylcholinesterase

Alzheimer’s disease is a progressive neurodegenerative disorder marked by declining cognitive function. While early-stage treatment focuses on acetylcholinesterase (AChE) inhibition, butyrylcholinesterase (BChE) activity increases as the disease progresses, contributing to cholinergic deficits and n...

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Detalhes bibliográficos

Principais autores:	Nika Jakobović, Petra Kalinovčić, Jakov Borovec, Ines Primožič, Tomica Hrenar
Formato:	Artigo
Idioma:	Inglês
Publicado em:	MDPI AG 2026-04-01
coleção:	Current Issues in Molecular Biology
Assuntos:	multiligand docking three-membered rings BChE fragment-based drug design
Acesso em linha:	https://www.mdpi.com/1467-3045/48/4/395
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