A method for computing the solubility limit of solids: Application to sodium chloride in water and alcohols

Molecular Simulation of the Thermal and Transport Properties of Three Alkali Nitrate Salts

(2009) Saivenkataraman Jayaraman et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Findings of the Challenge To Predict Aqueous Solubility

(2009) Anton J. Hopfinger et al.   Journal of Chemical Information and Modeling

Ab initio molecular dynamics calculations of ion hydration free energies

(2009) Kevin Leung et al.   JOURNAL OF CHEMICAL PHYSICS

Small Molecule Hydration Free Energies in Explicit Solvent: An Extensive Test of Fixed-Charge Atomistic Simulations

(2009) David L. Mobley et al.   Journal of Chemical Theory and Computation

Comparing the Use of Gibbs Ensemble and Grand-Canonical Transition-Matrix Monte Carlo Methods to Determine Phase Equilibria

(2008) Andrew S. Paluch et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Solubility Challenge: Can You Predict Solubilities of 32 Molecules Using a Database of 100 Reliable Measurements?

(2008) Antonio Llinàs et al.   Journal of Chemical Information and Modeling

Computation of interfacial properties via grand canonical transition matrix Monte Carlo simulation

(2008) Eric M. Grzelak et al.   JOURNAL OF CHEMICAL PHYSICS