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List of works by Pablo G. Debenedetti

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Signatures of distinct dynamical regimes in the energy landscape of a glass-forming liquid

scientific article published in Nature
Family of tunable spherically symmetric potentials that span the range from hard spheres to waterlike behavior

scientific article published on 17 May 2006
Evaporation rate of water in hydrophobic confinement

scientific article published on March 5, 2012
Water-like solvation thermodynamics in a spherically symmetric solvent model with two characteristic lengths

scholarly article
Relaxation processes in liquids: Variations on a theme by Stokes and Einstein

scientific article published on March 28, 2013
Formation of bioerodible polymeric microspheres and microparticles by rapid expansion of supercritical solutions

scientific article published on 01 September 1991
Structural order in glassy water

scientific article published on 30 June 2005
Modeling simple amphiphilic solutes in a Jagla solvent

scientific article published in January 2012
Molecular Dynamics Study of Carbon Dioxide Hydrate Dissociation

scientific article published on March 23, 2011
Structure of the first- and second-neighbor shells of simulated water: quantitative relation to translational and orientational order

scientific article published on 09 November 2007
Free Energy Barriers to Evaporation of Water in Hydrophobic Confinement

scientific article published on October 30, 2012
Computational Study of the Stability of the Miniprotein Trp-Cage, the GB1 β-Hairpin, and the AK16 Peptide, under Negative Pressure

scientific article published on 07 March 2014
Waterlike glass polyamorphism in a monoatomic isotropic Jagla model

scientific article
Long-term and high-temperature storage of supercritically-processed microparticulate protein powders

scientific article published on 01 October 1997
Homogeneous Nucleation of Methane Hydrate in Microsecond Molecular Dynamics Simulations

scientific article published on September 27, 2012
Two-structure thermodynamics for the TIP4P/2005 model of water covering supercooled and deeply stretched regions

scientific article published on January 2017
Advances in Computational Studies of the Liquid-Liquid Transition in Water and Water-Like Models

scientific article published on 28 August 2018
Chiral symmetry breaking in a microscopic model with asymmetric autocatalysis and inhibition

scientific article published on December 14, 2010
Temperature and length scale dependence of solvophobic solvation in a single-site water-like liquid

scientific article published in February 2013
Dissecting the Energetics of Hydrophobic Hydration of Polypeptides

scientific article published on November 16, 2011
Phase transitions, Kauzmann curves, and inverse melting

scientific article published on September 1, 2003
A computational investigation of attrition-enhanced chiral symmetry breaking in conglomerate crystals

scientific article published on November 7, 2013
A coarse-grained protein model in a water-like solvent

scientific article published on January 2013
Structure, dynamics, and thermodynamics of a family of potentials with tunable softness

scientific article published on August 28, 2011
Properties of model atomic free-standing thin films

scientific article published on March 21, 2011
The role of material flexibility on the drying transition of water between hydrophobic objects: A thermodynamic analysis

scientific article published on November 14, 2014
Hydrogen bond strength and network structure effects on hydration of non-polar molecules

scientific article published on December 10, 2010
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)].

scientific article published in April 2018
Computer Simulation of Water Sorption on Flexible Protein Crystals

scientific article published on September 11, 2012
Creation and Persistence of Chiral Asymmetry in a Microscopically Reversible Molecular Model

scientific article published on January 7, 2013
Molecular modeling of mechanical stresses on proteins in glassy matrices: Formalism

scientific article published on July 21, 2012
Nucleation in aqueous NaCl solutions shifts from 1-step to 2-step mechanism on crossing the spinodal

scientific article published on 01 March 2019
Erratum: "Two-structure thermodynamics for the TIP4P/2005 model of water covering supercooled and deeply stretched regions" [J. Chem. Phys. 146, 034502 (2017)].

scientific article published in February 2018
Microscopic Origin of Hysteresis in Water Sorption on Protein Matrices.

scientific article
Water's two-critical-point scenario in the Ising paradigm

scientific article published on 01 June 2019
Communication: Nucleation rates of supersaturated aqueous NaCl using a polarizable force field

article
Cavitation transition in the energy landscape: Distinct tensile yielding behavior in strongly and weakly attractive systems

scientific article published in March 2018
Second critical point in two realistic models of water

scientific article
Communication: Relationship between local structure and the stability of water in hydrophobic confinement.

scientific article published in December 2017
A Computational Study of the Ionic Liquid-Induced Destabilization of the Miniprotein Trp-Cage

scientific article published on 4 April 2018
Characterization of the liquid Li-solid Mo (1 1 0) interface from classical molecular dynamics for plasma-facing applications

Water's Thermal Pressure Drives the Temperature Dependence of Hydrophobic Hydration.

scientific article published on 11 December 2017
A cavitation transition in the energy landscape of simple cohesive liquids and glasses.

scientific article published in December 2016
Phase Equilibrium of Water with Hexagonal and Cubic Ice Using the SCAN Functional

scientific article published on 15 April 2021
Tribute to H. Eugene Stanley

scientific article published on December 8, 2011
Thermodynamic analysis of the stability of planar interfaces between coexisting phases and its application to supercooled water

scientific article published on 01 June 2019
Low temperature protein refolding suggested by molecular simulation

scientific article published on 01 November 2019
Effects of disulfide bridges and backbone connectivity on water sorption by protein matrices

scientific article published on 11 August 2017
Stability of Protein Structure during Nanocarrier Encapsulation: Insights on Solvent Effects from Simulations and Spectroscopic Analysis

scientific article published on 19 November 2020
Computational Investigation of the Effect of Pressure on Protein Stability

scientific article published on 04 April 2019

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