Determination of Molecule Category of Ligands Targeting the Ligand-Binding Pocket of Nuclear Receptors with Structural Elucidation and Machine Learning

Qinghua Wang, Zhe Wang, sheng Tian, Lingling Wang, Rongfan Tang, Yang Yu, Jingxuan Ge, Tingjun Hou, Haiping Hao, Huiyong Sun. Determination of Molecule Category of Ligands Targeting the Ligand-Binding Pocket of Nuclear Receptors with Structural Elucidation and Machine Learning. Journal of Chemical Information and Computer Sciences, 62(17):3993-4007, 2022. [doi]

Authors

Qinghua Wang

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Zhe Wang

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sheng Tian

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Lingling Wang

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Rongfan Tang

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Yang Yu

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Jingxuan Ge

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Tingjun Hou

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Haiping Hao

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Huiyong Sun

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