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Pre-training Molecular Graph Representation with 3D Geometry

Pre-training Molecular Graph Representation with 3D Geometry

7 October 2021
Shengchao Liu
Hanchen Wang
Weiyang Liu
Joan Lasenby
Hongyu Guo
Jian Tang
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Papers citing "Pre-training Molecular Graph Representation with 3D Geometry"

2 / 2 papers shown
Title
Understanding self-supervised Learning Dynamics without Contrastive
  Pairs
Understanding self-supervised Learning Dynamics without Contrastive Pairs
Yuandong Tian
Xinlei Chen
Surya Ganguli
SSL
104
258
0
12 Feb 2021
MoleculeNet: A Benchmark for Molecular Machine Learning
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
140
1,486
0
02 Mar 2017
1