Do we need different machine learning algorithms for QSAR modeling? A comprehensive assessment of 16 machine learning algorithms on 14 QSAR data sets

Zhenxing Wu, Minfeng Zhu, Yu Kang, Elaine Lai-Han Leung, Tailong Lei, Chao Shen, Dejun Jiang, Zhe Wang, Dong-Sheng Cao, Tingjun Hou. Do we need different machine learning algorithms for QSAR modeling? A comprehensive assessment of 16 machine learning algorithms on 14 QSAR data sets. Briefings in Bioinformatics, 22(4), 2021. [doi]

Authors

Zhenxing Wu

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Minfeng Zhu

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Yu Kang

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Elaine Lai-Han Leung

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Tailong Lei

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Chao Shen

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Dejun Jiang

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Zhe Wang

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Dong-Sheng Cao

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Tingjun Hou

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