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In Silico Evaluation of Synthetic Hydrophobic Fluorescent NBD- and DANSYL-Derivatives as Potential Inhibitors of Insect Chitinases

Docking calculations in semi-automatic virtual screening mode have been performed using AutoDock Vina (5 × 5 × 5 nm grid box, centered on the chain A) and FYTdock helper software. N-hexanoyl ciprofloxacin has been found to bind with chitinases from <i>Ostrinia furnacalis</i> (pdb codes: 7vrg, 6jaw,...

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Autori principali: Yaroslav Faletrov, Polina Yakovets, Nina S. Frolova
Natura: Artigo
Lingua:Inglês
Pubblicazione: MDPI AG 2025-11-01
Serie:Chemistry Proceedings
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Accesso online:https://www.mdpi.com/2673-4583/18/1/107
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