10 citations · 21 across the 11 of their papers we have counts for
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cs.LG2021★ 10 cited
Learning Attributed Graph Representations with Communicative Message Passing Transformer
Jianwen Chen, Shuangjia Zheng, Ying Song +2
Constructing appropriate representations of molecules lies at the core of numerous tasks such as material science, chemistry and drug designs. Recent researches abstract molecules…
q-bio.QM2021★ 3 cited
Quantitative Evaluation of Explainable Graph Neural Networks for Molecular Property Prediction
Jiahua Rao, Shuangjia Zheng, Yuedong Yang
Advances in machine learning have led to graph neural network-based methods for drug discovery, yielding promising results in molecular design, chemical synthesis planning, and mol…