A hybrid framework for improving uncertainty quantification in deep learning-based QSAR regression modeling

Dingyan Wang, Jie Yu, Lifan Chen, Xutong Li, Hualiang Jiang, Kaixian Chen, Mingyue Zheng, Xiaomin Luo. A hybrid framework for improving uncertainty quantification in deep learning-based QSAR regression modeling. J. Cheminformatics, 13(1):69, 2021. [doi]

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