Comparison of Confirmed Inactive and Randomly Selected Compounds as Negative Training Examples in Support Vector Machine-Based Virtual Screening

Kathrin Heikamp, Jürgen Bajorath. Comparison of Confirmed Inactive and Randomly Selected Compounds as Negative Training Examples in Support Vector Machine-Based Virtual Screening. Journal of Chemical Information and Computer Sciences, 53(7):1595-1601, 2013. [doi]

Authors

Kathrin Heikamp

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Jürgen Bajorath

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