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Stacked Generalization with Applicability Domain Outperforms Simple QSAR on in Vitro Toxicological Data

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https://hal.archives-ouvertes.fr/hal-02051775
Contributor : Jean-Paul Comet <>
Submitted on : Thursday, February 28, 2019 - 9:21:42 AM
Last modification on : Tuesday, May 26, 2020 - 6:50:56 PM

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Ingrid Grenet, Kevin Merlo, Jean-Paul Comet, Romain Tertiaux, David Rouquié, et al.. Stacked Generalization with Applicability Domain Outperforms Simple QSAR on in Vitro Toxicological Data. Journal of Chemical Information and Modeling, American Chemical Society, 2019, 59 (4), pp.1486-1496. ⟨10.1021/acs.jcim.8b00553⟩. ⟨hal-02051775⟩

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