Setting up and running molecular dynamics simulations of membrane proteins.
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The effect of amidation on the behaviour of antimicrobial peptidesMolecular dynamics simulations of biological membranes and membrane proteins using enhanced conformational sampling algorithmsModels for Predicting Drug Absorption From Oral Lipid-Based FormulationsMembrane Packing Problems: A short Review on computational Membrane Modeling Methods and ToolsInter-domain communication mechanisms in an ABC importer: a molecular dynamics study of the MalFGK2E complexSupramolecular Structure of Membrane-Associated Polypeptides by Combining Solid-State NMR and Molecular Dynamics SimulationsExploring O2 diffusion in A-type cytochrome c oxidases: molecular dynamics simulations uncover two alternative channels towards the binuclear siteAtomistic detailed mechanism and weak cation-conducting activity of HIV-1 Vpu revealed by free energy calculationsCharge-Triggered Membrane Insertion of Matrix Metalloproteinase-7, Supporter of Innate Immunity and TumorsUnderstanding Voltage Gating of Providencia stuartii Porins at Atomic Level.Allosteric signalling in the outer membrane translocation domain of PapC usher.Probing the conformation of FhaC with small-angle neutron scattering and molecular modeling.Interpretation of 2H-NMR experiments on the orientation of the transmembrane helix WALP23 by computer simulations.Modeling and simulation of ion channels.Cholesterol slows down the lateral mobility of an oxidized phospholipid in a supported lipid bilayer.Molecular dynamics simulation of Kv channel voltage sensor helix in a lipid membrane with applied electric fieldChanges in lipid density induce membrane curvature.Scents and sense: in silico perspectives on olfactory receptors.Indolicidin binding induces thinning of a lipid bilayerCongruency between biophysical data from multiple platforms and molecular dynamics simulation of the double-super helix model of nascent high-density lipoprotein.The conformational transition pathway of ATP binding cassette transporter MsbA revealed by atomistic simulations.Coarse-grained molecular dynamics provides insight into the interactions of lipids and cholesterol with rhodopsin.Putative active states of a prototypic g-protein-coupled receptor from biased molecular dynamics.Ligand-induced modulation of the free-energy landscape of G protein-coupled receptors explored by adaptive biasing techniquesMolecular dynamic simulation of the self-assembly of DAP12-NKG2C activating immunoreceptor complex.The conformational transition pathways of ATP-binding cassette transporter BtuCD revealed by targeted molecular dynamics simulation.Making structural sense of dimerization interfaces of delta opioid receptor homodimers.Modeling of ligand binding to G protein coupled receptors: cannabinoid CB1, CB2 and adrenergic β 2 AR.Structural insights into human GPCR protein OA1: a computational perspective.Assessing the relative stability of dimer interfaces in g protein-coupled receptors.Lipid interaction and membrane perturbation of human islet amyloid polypeptide monomer and dimer by molecular dynamics simulations.The structural dynamics of the flavivirus fusion peptide-membrane interactionThe Dynamic Process of Drug-GPCR Binding at Either Orthosteric or Allosteric Sites Evaluated by MetadynamicsA molecular-modeling toolbox aimed at bridging the gap between medicinal chemistry and computational sciences.Structural answers and persistent questions about how nicotinic receptors work.Molecular determinants and thermodynamics of the amyloid precursor protein transmembrane domain implicated in Alzheimer's disease.Exploring molecular mechanisms of ligand recognition by opioid receptors with metadynamics.Transmembrane signaling of chemotaxis receptor tar: insights from molecular dynamics simulation studiesInteraction of actin with carcinoembryonic antigen-related cell adhesion molecule 1 (CEACAM1) receptor in liposomes is Ca2+- and phospholipid-dependent.Substrate binding accelerates the conformational transitions and substrate dissociation in multidrug efflux transporter AcrB.
P2860
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P2860
Setting up and running molecular dynamics simulations of membrane proteins.
description
2007 nî lūn-bûn
@nan
2007年の論文
@ja
2007年論文
@yue
2007年論文
@zh-hant
2007年論文
@zh-hk
2007年論文
@zh-mo
2007年論文
@zh-tw
2007年论文
@wuu
2007年论文
@zh
2007年论文
@zh-cn
name
Setting up and running molecular dynamics simulations of membrane proteins.
@ast
Setting up and running molecular dynamics simulations of membrane proteins.
@en
type
label
Setting up and running molecular dynamics simulations of membrane proteins.
@ast
Setting up and running molecular dynamics simulations of membrane proteins.
@en
prefLabel
Setting up and running molecular dynamics simulations of membrane proteins.
@ast
Setting up and running molecular dynamics simulations of membrane proteins.
@en
P2093
P1433
P1476
Setting up and running molecular dynamics simulations of membrane proteins.
@en
P2093
Christian Kandt
D Peter Tieleman
Walter L Ash
P304
P356
10.1016/J.YMETH.2006.08.006
P577
2007-04-01T00:00:00Z