Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
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Backdoor opening mechanism in acetylcholinesterase based on X-ray crystallography and molecular dynamics simulationsStructures of Human Acetylcholinesterase Bound to Dihydrotanshinone I and Territrem B Show Peripheral Site FlexibilityMolecular dynamics simulations of arachidonic acid complexes with COX-1 and COX-2: insights into equilibrium behaviorEnergetics of Ortho-7 (oxime drug) translocation through the active-site gorge of tabun conjugated acetylcholinesteraseA wrench in the works of human acetylcholinesterase: soman induced conformational changes revealed by molecular dynamics simulationsBuilding a foundation for structure-based cellulosome design for cellulosic ethanol: Insight into cohesin-dockerin complexation from computer simulationMining electron density for functionally relevant protein polysterism in crystal structures.Allosteric Autoinhibition Pathway in Transcription Factor ERG: Dynamics Network and Mutant Experimental Evaluations.Gorge Motions of Acetylcholinesterase Revealed by Microsecond Molecular Dynamics Simulations.Gated Diffusion-controlled ReactionsMolecular dynamics simulations of the rotary motor F(0) under external electric fields across the membraneAccurate prediction of the binding free energy and analysis of the mechanism of the interaction of replication protein A (RPA) with ssDNA.The dynamics of ligand barrier crossing inside the acetylcholinesterase gorgeCatalytic mechanism and energy barriers for butyrylcholinesterase-catalyzed hydrolysis of cocaineLong route or shortcut? A molecular dynamics study of traffic of thiocholine within the active-site gorge of acetylcholinesteraseUnderstanding the specificity of a docking interaction between JNK1 and the scaffolding protein JIP1.Early relaxation dynamics in the LC 13 T cell receptor in reaction to 172 altered peptide ligands: a molecular dynamics simulation studyQAARM: quasi-anharmonic autoregressive model reveals molecular recognition pathways in ubiquitinDynamic switching mechanisms in LOV1 and LOV2 domains of plant phototropins.On the characterization of protein native state ensembles.Detection of allosteric signal transmission by information-theoretic analysis of protein dynamicsEnzyme Tunnels and Gates As Relevant Targets in Drug Design.How does activation loop phosphorylation modulate catalytic activity in the cAMP-dependent protein kinase: a theoretical study.Revealing an outward-facing open conformational state in a CLC Cl(-)/H(+) exchange transporterStudying the roles of W86, E202, and Y337 in binding of acetylcholine to acetylcholinesterase using a combined molecular dynamics and multiple docking approachGlobal and local molecular dynamics of a bacterial carboxylesterase provide insight into its catalytic mechanism.Synergistic Modification Induced Specific Recognition between Histone and TRIM24 via Fluctuation Correlation Network AnalysisFlexibility of aromatic residues in the active-site gorge of acetylcholinesterase: X-ray versus molecular dynamics.Gates of enzymes.Simulations of a protein crystal: explicit treatment of crystallization conditions links theory and experiment in the streptavidin-biotin complex.Dynamics of the streptavidin-biotin complex in solution and in its crystal lattice: distinct behavior revealed by molecular simulations.The gates of ion channels and enzymes.Structural and dynamic properties of water around acetylcholinesterase.Molecular dynamics of HIV1-integrase in complex with 93del - a structural perspective on the mechanism of inhibition.Computational Studies on Acetylcholinesterases.A Kepler Workflow Tool for Reproducible AMBER GPU Molecular Dynamics.Differential binding of bispyridinium oxime drugs with acetylcholinesterase.Molecular dynamics and principal components analysis of human telomeric quadruplex multimers.An investigation of G-quadruplex structural polymorphism in the human telomere using a combined approach of hydrodynamic bead modeling and molecular dynamics simulation.Molecular dynamics simulations of the ligand-binding domain of the ionotropic glutamate receptor GluR2.
P2860
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P2860
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
description
2001 nî lūn-bûn
@nan
2001 թուականի Օգոստոսին հրատարակուած գիտական յօդուած
@hyw
2001 թվականի օգոստոսին հրատարակված գիտական հոդված
@hy
2001年の論文
@ja
2001年論文
@yue
2001年論文
@zh-hant
2001年論文
@zh-hk
2001年論文
@zh-mo
2001年論文
@zh-tw
2001年论文
@wuu
name
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@ast
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@en
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@nl
type
label
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@ast
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@en
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@nl
prefLabel
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@ast
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@en
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@nl
P2093
P2860
P1433
P1476
Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.
@en
P2093
Börjesson U
McCammon JA
Philippopoulos M
P2860
P304
P356
10.1016/S0006-3495(01)75736-0
P407
P577
2001-08-01T00:00:00Z