Investigating the mechanism of peptide aggregation: insights from mixed monte carlo-molecular dynamics simulations.
about
A multiscale approach to characterize the early aggregation steps of the amyloid-forming peptide GNNQQNY from the yeast prion sup-35Ubiquitin-like protein from human placental extract exhibits collagenase activity.Low molecular weight oligomers of amyloid peptides display beta-barrel conformations: a replica exchange molecular dynamics study in explicit solvent.Formation and growth of oligomers: a Monte Carlo study of an amyloid tau fragmentThermodynamic selection of steric zipper patterns in the amyloid cross-beta spineMethods for Monte Carlo simulations of biomacromoleculesKinetics of amyloid aggregation: a study of the GNNQQNY prion sequence.Structural characterization of GNNQQNY amyloid fibrils by magic angle spinning NMRStructural complexity of a composite amyloid fibril.A variational model for oligomer-formation process of GNNQQNY peptide from yeast prion protein Sup35Combining coarse-grained protein models with replica-exchange all-atom molecular dynamics.All-atom computer simulations of amyloid fibrils disaggregation.Dynamics of locking of peptides onto growing amyloid fibrils.Virtual Screening for Dipeptide Aggregation: Toward Predictive Tools for Peptide Self-Assembly.A kinetic approach to the sequence-aggregation relationship in disease-related protein assemblyThermodynamic description of polymorphism in Q- and N-rich peptide aggregates revealed by atomistic simulation.Thermodynamic analysis of structural transitions during GNNQQNY aggregation.Thirteen decades of peptide synthesis: key developments in solid phase peptide synthesis and amide bond formation utilized in peptide ligation.Inhibition of GNNQQNY prion peptide aggregation by trehalose: a mechanistic view.Molecular simulations of self-assembling bio-inspired supramolecular systems and their connection to experiments.Are Amyloid Fibrils RNA-Traps? A Molecular Dynamics Perspective.Targeting Difficult Protein-Protein Interactions with Plain and General Computational Approaches
P2860
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P2860
Investigating the mechanism of peptide aggregation: insights from mixed monte carlo-molecular dynamics simulations.
description
2008 nî lūn-bûn
@nan
2008年の論文
@ja
2008年学术文章
@wuu
2008年学术文章
@zh-cn
2008年学术文章
@zh-hans
2008年学术文章
@zh-my
2008年学术文章
@zh-sg
2008年學術文章
@yue
2008年學術文章
@zh
2008年學術文章
@zh-hant
name
Investigating the mechanism of ...... olecular dynamics simulations.
@en
type
label
Investigating the mechanism of ...... olecular dynamics simulations.
@en
prefLabel
Investigating the mechanism of ...... olecular dynamics simulations.
@en
P2093
P2860
P50
P1433
P1476
Investigating the mechanism of ...... molecular dynamics simulations
@en
P2093
Giorgio Colombo
Giulia Morra
Massimiliano Meli
P2860
P304
P356
10.1529/BIOPHYSJ.107.121061
P407
P577
2008-02-08T00:00:00Z