Atomic-level characterization of the structural dynamics of proteins
about
Protein 3D structure computed from evolutionary sequence variationEvaluating the effects of cutoffs and treatment of long-range electrostatics in protein folding simulationsIdentification of direct protein targets of small moleculesCorrelation as a determinant of configurational entropy in supramolecular and protein systemsStructures of YAP protein domains reveal promising targets for development of new cancer drugsMarkov state model reveals folding and functional dynamics in ultra-long MD trajectoriesPrinciples and Overview of Sampling Methods for Modeling Macromolecular Structure and DynamicsBridging scales through multiscale modeling: a case study on protein kinase AKnotted proteins: A tangled tale of Structural BiologySmall Molecule Targeting of Protein-Protein Interactions through Allosteric Modulation of DynamicsHydrogen bond dynamics in membrane protein functionThermophilic proteins: insight and perspective from in silico experimentsExploring the role of receptor flexibility in structure-based drug discoveryRecent advances in QM/MM free energy calculations using reference potentialsSynergistic applications of MD and NMR for the study of biological systemsUnveiling Inherent Degeneracies in Determining Population-Weighted Ensembles of Interdomain Orientational Distributions Using NMR Residual Dipolar Couplings: Application to RNA Helix Junction Helix Motifs.Gaussian Accelerated Molecular Dynamics: Unconstrained Enhanced Sampling and Free Energy CalculationIntrinsic Localized Modes in ProteinsModeling transmembrane domain dimers/trimers of plexin receptors: implications for mechanisms of signal transmission across the membraneComplex intramolecular mechanics of G-actin--an elastic network studyLarge-scale asynchronous and distributed multidimensional replica exchange molecular simulations and efficiency analysisCalcium induced regulation of skeletal troponin--computational insights from molecular dynamics simulationsComparing Fast Pressure Jump and Temperature Jump Protein Folding Experiments and Simulations.Continuum molecular simulation of large conformational changes during ion-channel gatingAccessing protein conformational ensembles using room-temperature X-ray crystallographyStructure of a force-conveying cadherin bond essential for inner-ear mechanotransductionCircular Permutation of a WW Domain: Folding Still Occurs after Excising the Turn of the Folding-Nucleating HairpinDetermination of structural fluctuations of proteins from structure-based calculations of residual dipolar couplingsA structural and energetic model for the slow-onset inhibition of the Mycobacterium tuberculosis enoyl-ACP reductase InhA.Spatial elucidation of motion in proteins by ensemble-based structure calculation using exact NOEsThe role of distant mutations and allosteric regulation on LovD active site dynamicsNMR Polypeptide Backbone Conformation of the E. coli Outer Membrane Protein WWhen fast is better: protein folding fundamentals and mechanisms from ultrafast approachesFast-folding proteins under stressSynthetic biology outside the cell: linking computational tools to cell-free systemsCalculation and visualization of atomistic mechanical stresses in nanomaterials and biomoleculesEntropy-enthalpy transduction caused by conformational shifts can obscure the forces driving protein-ligand binding13C NMR reveals no evidence of n-π* interactions in proteinsModeling of arylamide helix mimetics in the p53 peptide binding site of hDM2 suggests parallel and anti-parallel conformations are both stable.Thermal adaptation of conformational dynamics in ribonuclease H
P2860
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P2860
Atomic-level characterization of the structural dynamics of proteins
description
2010 nî lūn-bûn
@nan
2010 թուականի Հոկտեմբերին հրատարակուած գիտական յօդուած
@hyw
2010 թվականի հոտեմբերին հրատարակված գիտական հոդված
@hy
2010年の論文
@ja
2010年論文
@yue
2010年論文
@zh-hant
2010年論文
@zh-hk
2010年論文
@zh-mo
2010年論文
@zh-tw
2010年论文
@wuu
name
Atomic-level characterization of the structural dynamics of proteins
@ast
Atomic-level characterization of the structural dynamics of proteins
@en
type
label
Atomic-level characterization of the structural dynamics of proteins
@ast
Atomic-level characterization of the structural dynamics of proteins
@en
prefLabel
Atomic-level characterization of the structural dynamics of proteins
@ast
Atomic-level characterization of the structural dynamics of proteins
@en
P2093
P2860
P3181
P356
P1433
P1476
Atomic-level characterization of the structural dynamics of proteins
@en
P2093
Eastwood MP
Lindorff-Larsen K
Maragakis P
P2860
P3181
P356
10.1126/SCIENCE.1187409
P407
P577
2010-10-15T00:00:00Z