Classifying 'Drug-likeness' with Kernel-Based Learning Methods.

Klaus-Robert Müller Gunnar Rätsch Sören Sonnenburg Sebastian Mika Michael Grimm Nikolaus Heinrich Classifying 'Drug-likeness' with Kernel-Based Learning Methods. 249-253 2005 45 Journal of Chemical Information and Modeling 2 http://dx.doi.org/10.1021/ci049737o db/journals/jcisd/jcisd45.html#MullerRSMGH05