AIMC Topic: Acetylcholinesterase

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Effects of mutations on the structure and function of silkworm type 1 acetylcholinesterase.

Pesticide biochemistry and physiology Nov 10, 2015
AChE is the target of organophosphate (OP) and carbamate (CB) pesticides, and mutations in the gene can significantly reduce insects' sensitivity to these pesticides. Bombyx mori is highly sensitive to pesticides. To investigate the effects of mutati...
Animals Models, Molecular Mutation Acetylcholinesterase Plasmids Bombyx
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Development of 3D-QSAR Model for Acetylcholinesterase Inhibitors Using a Combination of Fingerprint, Molecular Docking, and Structure-Based Pharmacophore Approaches.

Toxicological sciences : an official journal of the Society of Toxicology Jul 21, 2015
Acetylcholinesterase (AChE), a serine hydrolase vital for regulating the neurotransmitter acetylcholine in animals, has been used as a target for drugs and pesticides. With the increasing availability of AChE crystal structures, with or without ligan...
Humans Artificial Intelligence Animals Molecular Docking Simulation Imaging, Three-Dimensional Computational Biology Databases, Protein Nerve Tissue Proteins Models, Molecular GPI-Linked Proteins Insecticides Ligands Acetylcholinesterase Cholinesterase Inhibitors Expert Systems Catalytic Domain Molecular Conformation Quantitative Structure-Activity Relationship Binding Sites Peptide Mapping Nootropic Agents
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A modified binary particle swarm optimization with a machine learning algorithm and molecular docking for QSAR modelling of cholinesterase inhibitors.

SAR and QSAR in environmental research Sep 1, 2021
The acetylcholinesterase (AChE) and butyrylcholinesterase (BuChE) inhibitors play a key role in treating Alzheimer's disease. This study proposes an approach that integrates a modified binary particle swarm optimization (PSO) with a machine learning ...
Machine Learning Reproducibility of Results Molecular Docking Simulation Acetylcholinesterase Cholinesterase Inhibitors Databases, Chemical Quantitative Structure-Activity Relationship Butyrylcholinesterase
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