The early stage of folding of villin headpiece subdomain observed in a 200-nanosecond fully solvated molecular dynamics simulation.
about
Protein 3D structure computed from evolutionary sequence variationAb initio protein structure prediction using physicochemical potentials and a simplified off-lattice model.Exploratory studies of ab initio protein structure prediction: multiple copy simulated annealing, AMBER energy functions, and a generalized born/solvent accessibility solvation model.Electronic polarization stabilizes tertiary structure prediction of HP-36.Accurate prediction of stability changes in protein mutants by combining machine learning with structure based computational mutagenesis.Characterizing a partially ordered miniprotein through folding molecular dynamics simulations: Comparison with the experimental data.High-resolution x-ray crystal structures of the villin headpiece subdomain, an ultrafast folding protein.Fast protein folding kineticsProbing site-specific conformational distributions in protein folding with solid-state NMRWhat can solid state NMR contribute to our understanding of protein folding?Protein unfolding: rigidity lost.Effect of modulating unfolded state structure on the folding kinetics of the villin headpiece subdomainNew insights into the allosteric mechanism of human hemoglobin from molecular dynamics simulationsFolding network of villin headpiece subdomain.Using an amino acid fluorescence resonance energy transfer pair to probe protein unfolding: application to the villin headpiece subdomain and the LysM domain.Conformational transition pathway in the allosteric process of human glucokinase.The protein folding network indicates that the ultrafast folding mutant of villin headpiece subdomain has a deeper folding funnelFolding and misfolding of the papillomavirus E6 interacting peptide E6ap.Folding free-energy landscape of villin headpiece subdomain from molecular dynamics simulationsThermally induced protein unfolding probed by isotope-edited IR spectroscopy.Cytochrome b562 folding triggered by electron transfer: approaching the speed limit for formation of a four-helix-bundle protein.Theoretical investigation of the photoinitiated folding of HP-36.Reconciling the solution and X-ray structures of the villin headpiece helical subdomain: molecular dynamics simulations and double mutant cycles reveal a stabilizing cation-pi interaction.Ab initio folding of proteins with all-atom discrete molecular dynamics.Probing the folding transition state structure of the villin headpiece subdomain via side chain and backbone mutagenesis.A comparative analysis of the equilibrium dynamics of a designed protein inferred from NMR, X-ray, and computationsStudying the role of cooperative hydration in stabilizing folded protein states.Biomolecularmodeling and simulation: a field coming of age.The role of aromatic residues in the hydrophobic core of the villin headpiece subdomainStructural and dynamic evolution of the amphipathic N-terminus diversifies enzyme thermostability in the glycoside hydrolase family 12.The unusual internal motion of the villin headpiece subdomain.Finding pathways between distant local minima.Two-stage folding of HP-35 from ab initio simulationsMonte Carlo simulations of proteins in cages: influence of confinement on the stability of intermediate statesNative like structure in the unfolded state of the villin headpiece helical subdomain, an ultrafast folding proteinPrediction of protein thermostability with a direction- and distance-dependent knowledge-based potential.An improved OPLS-AA force field for carbohydrates.Enhanced docking with the mining minima optimizer: acceleration and side-chain flexibility.Different modes of interaction between hydrated magnesium ion and DNA functional groups: database analysis and ab initio studies.The role of plastic beta-hairpin and weak hydrophobic core in the stability and unfolding of a full sequence design protein.
P2860
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P2860
The early stage of folding of villin headpiece subdomain observed in a 200-nanosecond fully solvated molecular dynamics simulation.
description
1998 nî lūn-bûn
@nan
1998 թուականի Օգոստոսին հրատարակուած գիտական յօդուած
@hyw
1998 թվականի օգոստոսին հրատարակված գիտական հոդված
@hy
1998年の論文
@ja
1998年論文
@yue
1998年論文
@zh-hant
1998年論文
@zh-hk
1998年論文
@zh-mo
1998年論文
@zh-tw
1998年论文
@wuu
name
The early stage of folding of ...... molecular dynamics simulation.
@ast
The early stage of folding of ...... molecular dynamics simulation.
@en
type
label
The early stage of folding of ...... molecular dynamics simulation.
@ast
The early stage of folding of ...... molecular dynamics simulation.
@en
prefLabel
The early stage of folding of ...... molecular dynamics simulation.
@ast
The early stage of folding of ...... molecular dynamics simulation.
@en
P2093
P2860
P356
P1476
The early stage of folding of ...... molecular dynamics simulation.
@en
P2093
P2860
P304
P356
10.1073/PNAS.95.17.9897
P407
P577
1998-08-01T00:00:00Z