Kernel learning for ligand-based virtual screening: discovery of a new PPARγ agonist
Matthias Rupp, Timon Sebastian Schroeter, Ramona Steri, Ewgenij Proschak, K Hansen, Heiko Zettl, Oliver Rau, Manfred Schubert‐Zsilavecz, K-R Müller, Gisbert Schneider · Journal of Cheminformatics · 2010
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