An adaptive graph learning method for automated molecular interactions and properties predictions

Yuquan Li, Chang-Yu Hsieh, Ruiqiang Lu, Xiaoqing Gong, Xiaorui Wang, Pengyong Li, Shuo Liu, Yanan Tian, Dejun Jiang, Jiaxian Yan, Qifeng Bai, Huanxiang Liu, Shengyu Zhang, Xiaojun Yao. An adaptive graph learning method for automated molecular interactions and properties predictions. Nat. Mach. Intell., 4(7):645-651, 2022. [doi]

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