Predicting hydration free energies of polychlorinated aromatic compounds from the SAMPL-3 data set with FiSH and LIE models

Traian Sulea, Enrico O. Purisima. Predicting hydration free energies of polychlorinated aromatic compounds from the SAMPL-3 data set with FiSH and LIE models. Journal of Computer-Aided Molecular Design, 26(5):661-667, 2012. [doi]

Abstract

Abstract is missing.