Protein conformational dynamics / edited by Ke-li Han, Xin Zhang, Ming-jun Yang.

Springer eBooks

Protein folding simulations by generalized-ensemble algorithms -- Application of Markov State Models to Simulate Long Timescale Dynamics of Biological Macromolecules -- Understanding protein dynamics using conformational ensembles -- Generative Models of Conformational Dynamics -- Generalized spring tensor models for protein fluctuation dynamics and conformation changes -- The Joys and Perils of Flexible Fitting -- Coarse-Grained Models of the Proteins Backbone Conformational Dynamics -- Simulating protein folding in different environmental conditions -- Simulating the peptide folding kinetic related spectra based on the Markov State Model -- The Dilemma of Conformational Dynamics in Enzyme Catalysis: Perspectives from Theory and Experiment -- Exploiting protein intrinsic flexibility in drug design -- NMR and computational methods in the structural and dynamic characterization of ligand-receptor interactions -- Molecular Dynamics Simulation of Membrane Proteins -- Free-energy landscape of intrinsically disordered proteins investigated by all-atom multicanonical molecular dynamics -- Coordination and control inside simple biomolecular machines -- Multi-state Targeting Machinery Govern the Fidelity and Efficiency of Protein Localization -- Molecular dynamics simulations of F1-ATPase -- Chemosensorial G-proteins-coupled receptors: a perspective from computational methods.

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