Konovalov, Dmitry A., Sim, Nigel, Deconinck, Eric, Vander Heyden, Yvan, and Coomans, Danny (2008) Statistical confidence for variable selection in QSAR models via Monte Carlo cross-validation. Journal of Chemical Information and Modeling, 48 (2). pp. 370-383.

Konovalov, Dmitry A., Llewellyn, Lyndon E., Vander Heyden, Yvan, and Coomans, Danny (2008) Robust cross-validation of linear regression QSAR models. Journal of Chemical Information and Modeling, 48 (10). pp. 2081-2094.

Deconinck, Eric, Zhang, Menghui H., Coomans, Danny, and Vander Heyden, Yvan (2007) Evaluation of boosted regression trees (BRTs) and two-step BRT procedures to model and predict blood-brain barrier passage. Journal of Chemometrics, 21 (7-9). pp. 280-291.

Deconinck, E., Coomans, D., and Vander Heyden, Y. (2007) Exploration of linear modelling techniques and their combination with multivariate adaptive regression splines to predict gastro-intestinal absorption of drugs. Journal of Pharmaceutical and Biomedical Analysis, 43 (1). pp. 119-130.

Konovalov, Dmitry A., Coomans, Danny, Deconinck, Eric, and Vander Heyden, Yvan (2007) Benchmarking of QSAR models for blood-brain barrier permeation. Journal of Chemical Information and Modeling, 47 (4). pp. 1648-1656.

Deconinck, Eric, Zhang, Menghui H., Coomans, Danny, and Vander Heyden, Yvan (2006) Classification tree models for the prediction of blood−brain barrier passage of drugs. Journal of Chemical Information and Modeling, 46 (3). pp. 1410-1419.

Put, R., Van Gyseghem, E., Coomans, D., and Vander Heyden, Y. (2005) Selection of orthogonal reversed-phase HPLC systems by univariate and auto-associative multivariate regression trees. Journal of Chromatography A, 1096 (1-2). pp. 187-198.

Deconinck, E., Xu, Q.S., Put, R., Coomans, D., Massart, D.L., and Vander Heyden, Y. (2005) Prediction of gastro-intestinal absorption using multivariate adaptive regression splines. Journal of Pharmaceutical and Biomedical Analysis, 39 (5). pp. 1021-1030.

Deconinck, E., Hancock, T., Coomans, D., Massart, D.L., and Vander Heyden, Y. (2005) Classification of drugs in absorption classes using the classification and regression trees (CART) methodology. Journal of Pharmaceutical and Biomedical Analysis, 39 (1-2). pp. 91-103.

Hancock, Tim, Put, Raf, Coomans, Danny, Vander Heyden, Yvan, and Everingham, Yvette (2005) A performance comparison of modern statistical techniques for molecular descriptor selection and retention prediction in chromatographic QSRR studies. Chemometrics and Intelligent Laboratory Systems, 76 (2). pp. 185-196.

Questier, F., Put, R., Coomans, D., Walczak, B., and Vander Heyden, Y. (2005) The use of CART and multivariate regression trees for supervised and unsupervised feature selection. Chemometrics and Intelligent Laboratory Systems, 76 (1). pp. 45-54.

Put, R., Perrin, C., Questier, F., Coomans, D., Massart, D.L., and Vander Heyden, Y. (2003) Classification and regression tree analysis for molecular descriptor selection and retention prediction in chromatographic quantitative structure–retention relationship studies. Journal of Chromatography A, 988 (2). pp. 261-276.