Structure-activity relationship-based chemical classification of highly imbalanced Tox21 datasets

Gabriel Idakwo, Sundar Thangapandian, Joseph Luttrell IV, Yan Li, Nan Wang 0002, Zhaoxian Zhou, Huixiao Hong, Bei Yang, Chaoyang Zhang, Ping Gong. Structure-activity relationship-based chemical classification of highly imbalanced Tox21 datasets. J. Cheminformatics, 12(1):66, 2020. [doi]

Authors

Gabriel Idakwo

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Sundar Thangapandian

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Joseph Luttrell IV

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Yan Li

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Nan Wang 0002

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Zhaoxian Zhou

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Huixiao Hong

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Bei Yang

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Chaoyang Zhang

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Ping Gong

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