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CTAGE: Curvature-Based Topology-Aware Graph Embedding for Learning Molecular Representations
25 July 2023
Yili Chen
Zhengyu Li
Zheng Wan
Hui Yu
Xian Wei
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Papers citing
"CTAGE: Curvature-Based Topology-Aware Graph Embedding for Learning Molecular Representations"
2 / 2 papers shown
Title
Equiformer: Equivariant Graph Attention Transformer for 3D Atomistic Graphs
Yi-Lun Liao
Tess E. Smidt
73
142
0
23 Jun 2022
MoleculeNet: A Benchmark for Molecular Machine Learning
Zhenqin Wu
Bharath Ramsundar
Evan N. Feinberg
Joseph Gomes
C. Geniesse
Aneesh S. Pappu
K. Leswing
Vijay S. Pande
OOD
152
1,748
0
02 Mar 2017
1