Solute-solvent cavity and bridge functions. I. Varying size of the solute

Extraction of site-site bridge functions and effective pair potentials from simulations of polar molecular liquids

(2014) Gennady N. Chuev et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Extraction of atom–atom bridge and direct correlation functions from molecular simulations: A test for ambient water

(2013) Gennady N. Chuev et al.   CHEMICAL PHYSICS LETTERS

Bridge function of the repulsive Weeks–Chandler–Andersen (WCA) fluid

(2013) Daniel Tomazic et al.   CHEMICAL PHYSICS LETTERS

The spontaneous curvature of the water-hydrophobe interface

(2012) Felix Sedlmeier et al.   JOURNAL OF CHEMICAL PHYSICS

Bridge function for the dipolar fluid from simulation

(2012) Joël Puibasset et al.   JOURNAL OF CHEMICAL PHYSICS

Integral Equation Theory of Molecular Solvation Coupled with Quantum Mechanical/Molecular Mechanics Method in NWChem Package

(2012) Gennady N. Chuev et al.   Journal of Chemical Theory and Computation

A star-function based density functional study of the adsorption of Lennard-Jones fluid near its supercritical states

(2010) Lloyd L. Lee et al.   JOURNAL OF SUPERCRITICAL FLUIDS