about
Two-structure thermodynamics for the TIP4P/2005 model of water covering supercooled and deeply stretched regions.Effects of disulfide bridges and backbone connectivity on water sorption by protein matrices.Communication: Relationship between local structure and the stability of water in hydrophobic confinement.Water's Thermal Pressure Drives the Temperature Dependence of Hydrophobic Hydration.Forward flux sampling calculation of homogeneous nucleation rates from aqueous NaCl solutions.A cavitation transition in the energy landscape of simple cohesive liquids and glasses.Perspective: Surface freezing in water: A nexus of experiments and simulations.Microscopic Origin of Hysteresis in Water Sorption on Protein Matrices.Erratum: "Two-structure thermodynamics for the TIP4P/2005 model of water covering supercooled and deeply stretched regions" [J. Chem. Phys. 146, 034502 (2017)].Cavitation transition in the energy landscape: Distinct tensile yielding behavior in strongly and weakly attractive systems.Comment on "The putative liquid-liquid transition is a liquid-solid transition in atomistic models of water" [I and II: J. Chem. Phys. 135, 134503 (2011); J. Chem. Phys. 138, 214504 (2013)].A Computational Study of the Ionic Liquid-Induced Destabilization of the Miniprotein Trp-Cage.Computational Investigation of the Effect of Backbone Chiral Inversions on Polypeptide StructureCommunication: Nucleation rates of supersaturated aqueous NaCl using a polarizable force fieldAdvances in Computational Studies of the Liquid-Liquid Transition in Water and Water-Like ModelsLow temperature protein refolding suggested by molecular simulationPattern of property extrema in supercooled and stretched water models and a new correlation for predicting the stability limit of the liquid stateNucleation in aqueous NaCl solutions shifts from 1-step to 2-step mechanism on crossing the spinodalThermodynamic analysis of the stability of planar interfaces between coexisting phases and its application to supercooled waterComputational Investigation of the Effect of Pressure on Protein StabilityWater's two-critical-point scenario in the Ising paradigmInsights into Hydrophobic Ion Pairing from Molecular Simulation and Experiment
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P50
description
researcher
@en
wetenschapper
@nl
name
Pablo G Debenedetti
@en
Pablo G Debenedetti
@nl
type
label
Pablo G Debenedetti
@en
Pablo G Debenedetti
@nl
prefLabel
Pablo G Debenedetti
@en
Pablo G Debenedetti
@nl
P31
P496
0000-0003-1881-1728