Mathematical deep learning for pose and binding affinity prediction and ranking in D3R Grand Challenges

Duc Duy Nguyen, Zixuan Cang, Kedi Wu, Menglun Wang, Yin Cao, Guo-Wei Wei. Mathematical deep learning for pose and binding affinity prediction and ranking in D3R Grand Challenges. Journal of Computer-Aided Molecular Design, 33(1):71-82, 2019. [doi]

Authors

Duc Duy Nguyen

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Zixuan Cang

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Kedi Wu

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Menglun Wang

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Yin Cao

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Guo-Wei Wei

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