Force fields for divalent cations based on single-ion and ion-pair properties

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

Effective Interaction between Two Ion-Adsorbing Plates: Hofmeister Series and Salting-In/Salting-Out Phase Diagrams from a Global Mean-Field Analysis

(2012) Nadine Schwierz et al.   LANGMUIR

A Kirkwood-Buff Derived Force Field for Aqueous Alkali Halides

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

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

(2010) Maria Fyta et al.   JOURNAL OF CHEMICAL PHYSICS

Rational design of ion force fields based on thermodynamic solvation properties

(2009) Dominik Horinek et al.   JOURNAL OF CHEMICAL PHYSICS

Cation specific binding with protein surface charges

(2009) B. Hess et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Metal Binding Affinity and Selectivity in Metalloproteins: Insights from Computational Studies

(2008) Todor Dudev et al.   Annual Review of Biophysics