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Graph Multi-Similarity Learning for Molecular Property Prediction

Graph Multi-Similarity Learning for Molecular Property Prediction

31 January 2024
Hao Xu
Zhengyang Zhou
Pengyu Hong
ArXivPDFHTML

Papers citing "Graph Multi-Similarity Learning for Molecular Property Prediction"

5 / 5 papers shown
Title
Advancing Drug Discovery with Enhanced Chemical Understanding via Asymmetric Contrastive Multimodal Learning
Advancing Drug Discovery with Enhanced Chemical Understanding via Asymmetric Contrastive Multimodal Learning
Hao Xu
Yifei Wang
Yunrui Li
Pengyu Hong
Pengyu Hong
14
3
0
11 Nov 2023
Pairwise Similarity Learning is SimPLE
Pairwise Similarity Learning is SimPLE
Yandong Wen
Weiyang Liu
Yao Feng
Bhiksha Raj
Rita Singh
Adrian Weller
Michael J. Black
Bernhard Schölkopf
20
6
0
13 Oct 2023
Pre-training Molecular Graph Representation with 3D Geometry
Pre-training Molecular Graph Representation with 3D Geometry
Shengchao Liu
Hanchen Wang
Weiyang Liu
Joan Lasenby
Hongyu Guo
Jian Tang
112
294
0
07 Oct 2021
Chemical-Reaction-Aware Molecule Representation Learning
Chemical-Reaction-Aware Molecule Representation Learning
Hongwei Wang
Weijian Li
Xiaomeng Jin
Kyunghyun Cho
Heng Ji
Jiawei Han
Martin Burke
95
46
0
21 Sep 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
154
1,748
0
02 Mar 2017
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