A Comprehensive Review of Cholinesterase Modeling and Simulation

A Comprehensive Review of Cholinesterase Modeling and Simulation

The present article reviews published efforts to study acetylcholinesterase and butyrylcholinesterase structure and function using computer-based modeling and simulation techniques. Structures and models of both enzymes from various organisms, including rays, mice, and humans, are discussed to highl...

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Bibliographic Details
Main Authors:	Danna De Boer, Nguyet Nguyen, Jia Mao, Jessica Moore, Eric J. Sorin
Format:	Article
Language:	English
Published:	MDPI AG 2021-04-01
Series:	Biomolecules
Subjects:	acetylcholinesterase butyrylcholinesterase docking molecular dynamics hydrolysis molecular recognition
Online Access:	https://www.mdpi.com/2218-273X/11/4/580

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