A Bayesian Approach to in Silico Blood-Brain Barrier Penetration Modeling. - Ines Filipa Martins; Ana L. Teixeira; Luis Pinheiro; André O. Falcão (J. Chem. Inf. Model., 2012)

ThermInfo: Collecting, Retrieving, and Estimating Reliable Thermochemical Data - Ana L. Teixeira; Rui C. Santos; João Paulo Leal; Jose A. Martinho Simoes; André O. Falcão (CoRR, 2013)

Automated Identification and Classification of Stereochemistry: Chirality and Double Bond Stereoisomerism - Ana L. Teixeira; João Paulo Leal; André O. Falcão (CoRR, 2013)

Random forests for feature selection in QSPR Models - an application for predicting standard enthalpy of formation of hydrocarbons. - Ana L. Teixeira; João Paulo Leal; André O. Falcão (J. Cheminformatics, 2013)

Noncontiguous Atom Matching Structural Similarity Function. - Ana L. Teixeira; André O. Falcão (J. Chem. Inf. Model., 2013)

Structural Similarity Based Kriging for Quantitative Structure Activity and Property Relationship Modeling. - Ana L. Teixeira; André O. Falcão (J. Chem. Inf. Model., 2014)