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Acetylcholinesterase as a Target for Heliotridine-Type Alkaloids Isolated from Plants: A Computational Study

The enzyme acetylcholinesterase (AChE) acts in mammalians and insects. Its inhibitors are considered to treat human disease and to develop insecticides. Docking calculations were performed by using AutoDock Vina and Protein–Ligand ANTSystem (PLANTS) on the <i>Torpedo californica</i> AChE complexes o...

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Furkejuvvon:
Váldodahkkit: Andrea Defant, Thamere Cheriet, Ines Mancini
Materiálatiipa: Artigo
Giella:Inglês
Almmustuhtton: MDPI AG 2024-11-01
Ráidu:Chemistry Proceedings
Fáttát:
plant metabolite
pyrrolizidine alkaloid
AChE inhibitor
insecticidal activity
molecular docking
ADME/toxicity prediction
Liŋkkat:https://www.mdpi.com/2673-4583/16/1/102
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