A Representation to Apply Usual Data Mining Techniques to Chemical Reactions. - Frank Hoonakker; Nicolas Lachiche; Alexandre Varnek; Alain Wagner (IEA/AIE (2), 2010)

A Representation to Apply Usual Data Mining Techniques to Chemical reactions - Illustration on the Rate Constant of SN2 reactions in water. - Frank Hoonakker; Nicolas Lachiche; Alexandre Varnek; Alain Wagner (Int. J. Artif. Intell. Tools, 2011)

Design and Synthesis of New Antioxidants Predicted by the Model Developed on a Set of Pulvinic Acid Derivatives. - Antoine Le Roux; Igor Kuzmanovski; Damien Habrant; Stéphane Meunier; Pierre Bischoff; Brice Nadal; Sophie A.-L. Thetiot-Laurent; Thierry Le Gall; Alain Wagner; Marjana Novic (J. Chem. Inf. Model., 2011)