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The Dynamics of Ligand Barrier Crossing inside the Acetylcholinesterase Gorge

The dynamics of ligand movement through the constricted region of the acetylcholinesterase gorge is important in understanding how the ligand gains access to and is released from the active site of the enzyme. Molecular dynamics simulations of the simple ligand, tetramethylammonium, crossing this bo...

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Detalhes bibliográficos
Main Authors: Bui, Jennifer M., Henchman, Richard H., McCammon, J. Andrew
Formato: Artigo
Idioma:Inglês
Publicado em: Biophysical Society 2003
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC1303452/
https://ncbi.nlm.nih.gov/pubmed/14507691
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