Prediction of n-octanol/water partition coefficients and acidity constants (pKa) in the SAMPL7 blind challenge with the IEFPCM-MST model. - Antonio Viayna; Silvana Pinheiro; Carles Curutchet; F. Javier Luque; William J. Zamora (J. Comput. Aided Mol. Des., 2021)