Comparing the Influence of Simulated Experimental Errors on 12 Machine Learning Algorithms in Bioactivity Modeling Using 12 Diverse Data Sets

Isidro Cortes-Ciriano, Andreas Bender, Thérèse E. Malliavin. Comparing the Influence of Simulated Experimental Errors on 12 Machine Learning Algorithms in Bioactivity Modeling Using 12 Diverse Data Sets. Journal of Chemical Information and Computer Sciences, 55(7):1413-1425, 2015. [doi]

Authors

Isidro Cortes-Ciriano

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Andreas Bender

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Thérèse E. Malliavin

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