Mark J Embrechts

Predictive cheminformatics in drug discovery: statistical modeling for analysis of micro-array and gene expression data.

Michael P. Krein, N Sukumar, Michael P Krein, 2012, Methods in molecular biology.

Classification of Metabolites with Kernel-Partial Least Squares (K-PLS)

Sean Ekins, Mark J Embrechts, S. Ekins, 2007, Drug Metabolism and Disposition.