Specific ion effects for polyelectrolytes in aqueous and non-aqueous media: the importance of the ion solvation behavior

Probing the Hofmeister series beyond water: Specific-ion effects in non-aqueous solvents

(2018) Virginia Mazzini et al.   JOURNAL OF CHEMICAL PHYSICS

A refined polarizable water model for the coarse-grained MARTINI force field with long-range electrostatic interactions

(2017) Julian Michalowsky et al.   JOURNAL OF CHEMICAL PHYSICS

Beyond the Hofmeister Series: Ion-Specific Effects on Proteins and Their Biological Functions

(2017) Halil I. Okur et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Aqueous ionic liquids and their influence on peptide conformations: denaturation and dehydration mechanisms

(2017) Diddo Diddens et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Ability of the Poisson–Boltzmann equation to capture molecular dynamics predicted ion distribution around polyelectrolytes

(2017) Piotr Batys et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

What is the fundamental ion-specific series for anions and cations? Ion specificity in standard partial molar volumes of electrolytes and electrostriction in water and non-aqueous solvents

(2017) Virginia Mazzini et al.   Chemical Science

Proteins in Ionic Liquids: Current Status of Experiments and Simulations

(2017) Christian Schröder   Topics in Current Chemistry

Water-Mediated Ion Pairing: Occurrence and Relevance

(2016) Nico F. A. van der Vegt et al.   CHEMICAL REVIEWS

Specific-ion effects in non-aqueous systems

(2016) Virginia Mazzini et al.   CURRENT OPINION IN COLLOID & INTERFACE SCIENCE

Combined influence of ectoine and salt: spectroscopic and numerical evidence for compensating effects on aqueous solutions

(2016) Marc Benjamin Hahn et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Atomistic insights into deep eutectic electrolytes: the influence of urea on the electrolyte salt LiTFSI in view of electrochemical applications

(2016) Volker Lesch et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Preferential solvation and ion association properties in aqueous dimethyl sulfoxide solutions

(2016) Anand Narayanan Krishnamoorthy et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Protein stabilization and enzyme activation in ionic liquids: specific ion effects

(2015) Hua Zhao   JOURNAL OF CHEMICAL TECHNOLOGY AND BIOTECHNOLOGY

Peptides in the presence of aqueous ionic liquids: tunable co-solutes as denaturants or protectants?

(2015) Volker Lesch et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Water structure and chaotropicity: their uses, abuses and biological implications

(2015) Philip Ball et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Importance of Varying Permittivity on the Conductivity of Polyelectrolyte Solutions

(2015) Florian Fahrenberger et al.   PHYSICAL REVIEW LETTERS

Specific Ion Binding to Carboxylic Surface Groups and the pH Dependence of the Hofmeister Series

(2014) Nadine Schwierz et al.   LANGMUIR

Beyond Hofmeister

(2014) Pavel Jungwirth et al.   Nature Chemistry

GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit

(2013) Sander Pronk et al.   BIOINFORMATICS

Reversal of the Hofmeister Series: Specific Ion Effects on Peptides

(2013) Jana Paterová et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Osmolyte Effects: Impact on the Aqueous Solution around Charged and Neutral Spheres

(2013) Jens Smiatek   JOURNAL OF PHYSICAL CHEMISTRY B

Anionic and Cationic Hofmeister Effects on Hydrophobic and Hydrophilic Surfaces

(2013) Nadine Schwierz et al.   LANGMUIR

Progress in Modeling of Ion Effects at the Vapor/Water Interface

(2012) Roland R. Netz et al.   Annual Review of Physical Chemistry

Hofmeister Phenomena: An Update on Ion Specificity in Biology

(2012) Pierandrea Lo Nostro et al.   CHEMICAL REVIEWS

Ionic force field optimization based on single-ion and ion-pair solvation properties: Going beyond standard mixing rules

(2012) Maria Fyta et al.   JOURNAL OF CHEMICAL PHYSICS

Ion-specific counterion condensation on charged peptides: Poisson–Boltzmann vs. atomistic simulations

(2012) Jan Heyda et al.   Soft Matter

A Kirkwood-Buff Derived Force Field for Aqueous Alkali Halides

(2011) Moon Bae Gee et al.   Journal of Chemical Theory and Computation

Can Simulations Quantitatively Predict Peptide Transfer Free Energies to Urea Solutions? Thermodynamic Concepts and Force Field Limitations

(2011) Dominik Horinek et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Ion Pairing in Aqueous Electrolyte Solutions with Biologically Relevant Anions

(2011) Pritam Ganguly et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Hofmeister Ion Interactions with Model Amide Compounds

(2011) Elena A. Algaer et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Solubilities of NaCl, KCl, LiCl, and LiBr in Methanol, Ethanol, Acetone, and Mixed Solvents and Correlation Using the LIQUAC Model

(2010) Miyi Li et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Effect of Ions on the Structure of Water: Structure Making and Breaking

(2009) Yizhak Marcus   CHEMICAL REVIEWS

On the Theory of Solute Solubility in Mixed Solvents

(2008) Paul E. Smith et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Charge Asymmetries in Hydration of Polar Solutes

(2008) David L. Mobley et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Specific Ion Binding to Macromolecules:  Effects of Hydrophobicity and Ion Pairing

(2008) Mikael Lund et al.   LANGMUIR