Does Rational Selection of Training and Test Sets Improve the Outcome of QSAR Modeling?

Martin, Todd M ; Harten, Paul ; Young, Douglas M ; Muratov, Eugene N ; Golbraikh, Alexander ; Zhu, Hao ; Tropsha, Alexander

Journal of chemical information and modeling, 2012-10, Vol.52 (10), p.2570-2578 [Periódico revisado por pares]

Washington, DC: American Chemical Society

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