Projected and hidden Markov models for calculating kinetics and metastable states of complex molecules.
about
Markov state models of biomolecular conformational dynamicsAnalytical methods for structural ensembles and dynamics of intrinsically disordered proteinsHigh-resolution visualisation of the states and pathways sampled in molecular dynamics simulationsPredicting the Kinetics of RNA Oligonucleotides Using Markov State Models.Migration of small ligands in globins: Xe diffusion in truncated hemoglobin N.Conformational Heterogeneity in the Michaelis Complex of Lactate Dehydrogenase: An Analysis of Vibrational Spectroscopy Using Markov and Hidden Markov ModelsVariational Koopman models: Slow collective variables and molecular kinetics from short off-equilibrium simulations.Binding Kinetics in Drug Discovery.Estimation and uncertainty of reversible Markov models.Projected metastable Markov processes and their estimation with observable operator models.Protein conformational plasticity and complex ligand-binding kinetics explored by atomistic simulations and Markov models.Perspective: Markov models for long-timescale biomolecular dynamics.VAMPnets for deep learning of molecular kinetics.RNA Structural Dynamics As Captured by Molecular Simulations: A Comprehensive Overview.Complete protein-protein association kinetics in atomic detail revealed by molecular dynamics simulations and Markov modelling.Exploring the free energy gain of phase separation via Markov state modeling.Dimensional reduction of Markov state models from renormalization group theory.Variational tensor approach for approximating the rare-event kinetics of macromolecular systems.Gaussian Markov transition models of molecular kinetics.Dynamic properties of force fields.Linking time-series of single-molecule experiments with molecular dynamics simulations by machine learning.Atomic resolution mechanism of ligand binding to a solvent inaccessible cavity in T4 lysozyme.Constructing Markov State Models to elucidate the functional conformational changes of complex biomolecules
P2860
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P2860
Projected and hidden Markov models for calculating kinetics and metastable states of complex molecules.
description
2013 nî lūn-bûn
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2013年学术文章
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name
Projected and hidden Markov mo ...... e states of complex molecules.
@en
Projected and hidden Markov mo ...... e states of complex molecules.
@nl
type
label
Projected and hidden Markov mo ...... e states of complex molecules.
@en
Projected and hidden Markov mo ...... e states of complex molecules.
@nl
prefLabel
Projected and hidden Markov mo ...... e states of complex molecules.
@en
Projected and hidden Markov mo ...... e states of complex molecules.
@nl
P2093
P2860
P356
P1476
Projected and hidden Markov mo ...... e states of complex molecules.
@en
P2093
Jan-Hendrik Prinz
Nuria Plattner
P2860
P304
P356
10.1063/1.4828816
P407
P577
2013-11-01T00:00:00Z