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Specific Ion Binding to Nonpolar Surface Patches of Proteins

Journal of the American Chemical Society, 2008-09, Vol.130 (35), p.11582-11583

2008

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Homogeneous Freezing of Water Starts in the Subsurface

The journal of physical chemistry. B, 2006-09, Vol.110 (37), p.18126-18129

2006

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Quantification and Rationalization of the Higher Affinity of Sodium over Potassium to Protein Surfaces

Proceedings of the National Academy of Sciences - PNAS, 2006-10, Vol.103 (42), p.15440-15444

2006

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Monitoring Ice Nucleation in Pure and Salty Water via High-Speed Imaging and Computer Simulations

Journal of physical chemistry. C, 2008-05, Vol.112 (20), p.7631-7636

2008

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Ionic force field optimization based on single-ion and ion-pair solvation properties

The Journal of chemical physics, 2010-01, Vol.132 (2), p.024911-024911-10

2010

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Effect of Surface Pollution on Homogeneous Ice Nucleation: A Molecular Dynamics Study

Journal of physical chemistry. C, 2010-05, Vol.114 (17), p.7831-7838

2010

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Specific Ion Effects at Protein Surfaces: A Molecular Dynamics Study of Bovine Pancreatic Trypsin Inhibitor and Horseradish Peroxidase in Selected Salt Solutions

The journal of physical chemistry. B, 2006-04, Vol.110 (13), p.7036-7043

2006

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Molecular dynamics simulations of freezing of water and salt solutions

Journal of molecular liquids, 2007-05, Vol.134 (1), p.64-70

2007

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Ion-specific thermodynamics of multicomponent electrolytes: A hybrid HNC/MD approach

The Journal of chemical physics, 2009-10, Vol.131 (15), p.154109-154109-12

2009

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Specificity of Ion−Protein Interactions: Complementary and Competitive Effects of Tetrapropylammonium, Guanidinium, Sulfate, and Chloride Ions

The journal of physical chemistry. B, 2009-03, Vol.113 (10), p.3227-3234

2009

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Brine rejection from freezing salt solutions: A molecular dynamics study

Physical review letters, 2005-09, Vol.95 (14), p.148501.1-148501.4, Article 148501

2005

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Molecular Structure of Surface-Active Salt Solutions: Photoelectron Spectroscopy and Molecular Dynamics Simulations of Aqueous Tetrabutylammonium Iodide

The journal of physical chemistry. B, 2004-09, Vol.108 (38), p.14558-14564

2004

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Specific ion adsorption at the air/water interface: The role of hydrophobic solvation

Chemical physics letters, 2009-09, Vol.479 (4), p.173-183

2009

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Selected biologically relevant ions at the air/water interface: A comparative molecular dynamics study

Biophysical chemistry, 2006-12, Vol.124 (3), p.238-242

2006

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Propensity of soft ions for the air/water interface

Current opinion in colloid & interface science, 2004-08, Vol.9 (1), p.67-73

2004

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Ion specific effects of sodium and potassium on the catalytic activity of HIV-1 protease

Physical chemistry chemical physics : PCCP, 2009-01, Vol.11 (35), p.7599-7604

2009

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Aqueous Ionic and Complementary Zwitterionic Soluble Surfactants: Molecular Dynamics Simulations and Sum Frequency Generation Spectroscopy of the Surfaces

Langmuir, 2006-03, Vol.22 (6), p.2498-2505

2006

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Interior and Interfacial Aqueous Solvation of Benzene Dicarboxylate Dianions and Their Methylated Analogues: A Combined Molecular Dynamics and Photoelectron Spectroscopy Study

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2005-06, Vol.109 (23), p.5042-5049

2005

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Effect of bromide on the interfacial structure of aqueous tetrabutylammonium iodide: Photoelectron spectroscopy and molecular dynamics simulations

Chemical physics letters, 2005-07, Vol.410 (4), p.222-227

2005

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Computer Modeling and Simulations on Flexible Bifunctional Systems: Intramolecular Energy Transfer Implications

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2003-05, Vol.107 (18), p.3404-3413

2003

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Specific Ion Binding to Nonpolar Surface Patches of Proteins

Homogeneous Freezing of Water Starts in the Subsurface

Quantification and Rationalization of the Higher Affinity of Sodium over Potassium to Protein Surfaces

Monitoring Ice Nucleation in Pure and Salty Water via High-Speed Imaging and Computer Simulations

Ionic force field optimization based on single-ion and ion-pair solvation properties

Effect of Surface Pollution on Homogeneous Ice Nucleation: A Molecular Dynamics Study

Specific Ion Effects at Protein Surfaces: A Molecular Dynamics Study of Bovine Pancreatic Trypsin Inhibitor and Horseradish Peroxidase in Selected Salt Solutions

Molecular dynamics simulations of freezing of water and salt solutions

Ion-specific thermodynamics of multicomponent electrolytes: A hybrid HNC/MD approach

Specificity of Ion−Protein Interactions: Complementary and Competitive Effects of Tetrapropylammonium, Guanidinium, Sulfate, and Chloride Ions

Brine rejection from freezing salt solutions: A molecular dynamics study

Molecular Structure of Surface-Active Salt Solutions: Photoelectron Spectroscopy and Molecular Dynamics Simulations of Aqueous Tetrabutylammonium Iodide

Specific ion adsorption at the air/water interface: The role of hydrophobic solvation

Selected biologically relevant ions at the air/water interface: A comparative molecular dynamics study

Propensity of soft ions for the air/water interface

Ion specific effects of sodium and potassium on the catalytic activity of HIV-1 protease

Aqueous Ionic and Complementary Zwitterionic Soluble Surfactants: Molecular Dynamics Simulations and Sum Frequency Generation Spectroscopy of the Surfaces

Interior and Interfacial Aqueous Solvation of Benzene Dicarboxylate Dianions and Their Methylated Analogues: A Combined Molecular Dynamics and Photoelectron Spectroscopy Study

Effect of bromide on the interfacial structure of aqueous tetrabutylammonium iodide: Photoelectron spectroscopy and molecular dynamics simulations

Computer Modeling and Simulations on Flexible Bifunctional Systems: Intramolecular Energy Transfer Implications

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