Weisfeiler and Leman go Machine Learning: The Story so far

被引:0
|
作者
Morris, Christopher [1 ]
Lipman, Yaron [2 ]
Maron, Haggai [3 ]
Rieck, Bastian [4 ,5 ]
Kriege, Nils M. [6 ,7 ]
Grohe, Martin [1 ]
Fey, Matthias [8 ]
Borgwardt, Karsten [9 ,10 ,11 ]
机构
[1] Rhein Westfal TH Aachen, Dept Comp Sci, Aachen, Germany
[2] Weizmann Inst Sci, Dept Comp Sci & Appl Math, Meta AI Res, Rehovot, Israel
[3] NVIDIA Res, Tel Aviv, Israel
[4] Helmholtz Zentrum Munchen, AIDOS Lab, Inst AI Hlth, Munich, Germany
[5] Tech Univ Munich, Munich, Germany
[6] Univ Vienna, Fac Comp Sci, Vienna, Austria
[7] Univ Vienna, Res Network Data Sci, Vienna, Austria
[8] Kumo AI, Mountain View, CA USA
[9] Swiss Fed Inst Technol, Dept Biosyst Sci & Engn, Machine Learning & Computat Biol Lab, Basel, Switzerland
[10] Swiss Inst Bioinformat, Lausanne, Switzerland
[11] Max Planck Inst Biochem, Martinsried, Germany
关键词
Machine learning for graphs; Graph neural networks; Weisfeiler-Leman algorithm; expressivity; equivariance; SHERALI-ADAMS RELAXATIONS; NEURAL-NETWORK; GRAPH ISOMORPHISM; DARC SYSTEM; KERNELS; CLASSIFICATION; INFORMATION; GENERATION; LOGICS;
D O I
暂无
中图分类号
TP [自动化技术、计算机技术];
学科分类号
0812 ;
摘要
In recent years, algorithms and neural architectures based on the Weisfeiler-Leman algorithm, a well-known heuristic for the graph isomorphism problem, have emerged as a powerful tool for machine learning with graphs and relational data. Here, we give a comprehensive overview of the algorithm's use in a machine-learning setting, focusing on the supervised regime. We discuss the theoretical background, show how to use it for supervised graph and node representation learning, discuss recent extensions, and outline the algorithm's connection to (permutation-)equivariant neural architectures. Moreover, we give an overview of current applications and future directions to stimulate further research.
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页数:59
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