about
Ligand-modulated interactions between charged monolayer-protected Au144(SR)60 gold nanoparticles in physiological saline.Insights into scFv:drug binding using the molecular dynamics simulation and free energy calculation.Aspheric Solute Ions Modulate Gold Nanoparticle Interactions in an Aqueous Solution: An Optimal Way To Reversibly Concentrate Functionalized NanoparticlesInsights into the mechanisms of the selectivity filter of Escherichia coli aquaporin Z.Interaction between functionalized gold nanoparticles in physiological saline.Exploring the free-energy landscapes of biological systems with steered molecular dynamics.Diffusion in periodic potentials with path integral hyperdynamicsElongation affinity, activation barrier, and stability of Aβ42 oligomers/fibrils in physiological saline.Mercury inhibits the L170C mutant of aquaporin Z by making waters clog the water channel.1,3-propanediol binds deep inside the channel to inhibit water permeation through aquaporins.Molecular dynamics study of human carbonic anhydrase II in complex with Zn(2+) and acetazolamide on the basis of all-atom force field simulationsHybrid Steered Molecular Dynamics Approach to Computing Absolute Binding Free Energy of Ligand-Protein Complexes: A Brute Force Approach That Is Fast and Accurate.Computing Protein-Protein Association Affinity with Hybrid Steered Molecular DynamicsDetermination of equilibrium free energy from nonequilibrium work measurements.In silico experiments of single-chain antibody fragment against drugs of abuse.Erythritol predicted to inhibit permeation of water and solutes through the conducting pore of P. falciparum aquaporin.Does Plasmodium falciparum have an Achilles' heel?On the Crooks fluctuation theorem and the Jarzynski equality.Glycerol inhibits water permeation through Plasmodium falciparum aquaglyceroporin.An exact formulation of hyperdynamics simulations.In silico study of Aquaporin V: Effects and affinity of the central pore-occluding lipidComputing membrane-AQP5-phosphatidylserine binding affinities with hybrid steered molecular dynamics approach.Free-energy landscape of glycerol permeation through aquaglyceroporin GlpF determined from steered molecular dynamics simulations.Nonequilibrium fluctuation-dissipation theorem of Brownian dynamics.Thermodynamics of Amyloid-β Fibril Elongation: Atomistic Details of the Transition State.Affinity and path of binding xylopyranose unto E. coli xylose permease.Computing osmotic permeabilities of aquaporins AQP4, AQP5, and GlpF from near-equilibrium simulations.Computing the binding affinity of a ligand buried deep inside a protein with the hybrid steered molecular dynamics.Transition rate prefactors for systems of many degrees of freedom.Efficient transition path sampling for systems with multiple reaction pathways.Finding transition paths and rate coefficients through accelerated Langevin dynamics.Consistent derivation of impurity resistivity from the force-balance equation.Quantum Boltzmann equation and Kubo formula for electronic transport in solids.Nonperturbative balance equations for the nonequilibrium electron-phonon-impurity system in an applied high electric field.Chaotic Behavior in a Dynamic System Related to the Stationary Path of the Path-Integral for a Brownian Particle in a Double-Well PotentialGibbs Free-Energy Gradient along the Path of Glucose Transport through Human Glucose Transporter 3Path integral approach to Brownian motion driven with an ac forceTransient response of a Brownian particle with general dampingSurface diffusion in the low-friction limit: Occurrence of long jumpsDynamics of adatoms on solid surfaces
P50
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P50
description
researcher
@en
wetenschapper
@nl
հետազոտող
@hy
name
Liao Y Chen
@ast
Liao Y Chen
@en
Liao Y Chen
@es
Liao Y Chen
@nl
Liao Y Chen
@sl
type
label
Liao Y Chen
@ast
Liao Y Chen
@en
Liao Y Chen
@es
Liao Y Chen
@nl
Liao Y Chen
@sl
altLabel
Liao-Yuan Chen
@en
Liaoyuan Chen
@en
prefLabel
Liao Y Chen
@ast
Liao Y Chen
@en
Liao Y Chen
@es
Liao Y Chen
@nl
Liao Y Chen
@sl
P106
P31
P496
0000-0003-1911-8634