title: Performance of the IEF-MST solvation continuum model in the SAMPL2 blind test prediction of hydration and tautomerization free energies.
authors.affiliation: Departament de Fisicoquímica and Institut de Biomedicina, Facultat de Farmàcia, Universitat de Barcelona, Av. Diagonal 643, Barcelona, Spain.
authors.forename: Ignacio
authors.initials: I
authors.lastname: Soteras
authors.forename: Modesto
authors.initials: M
authors.lastname: Orozco
authors.forename: F Javier
authors.initials: FJ
authors.lastname: Luque
mesh_terms: D003198:Computer Simulation; D007536:Isomerism; D008956:Models, Chemical; D012995:Solubility; D013816:Thermodynamics