Publication Type
Conference Proceeding Article
Version
publishedVersion
Publication Date
2-2021
Abstract
Graph neural networks (GNNs) have become the de facto standard for representation learning on graphs, which derive effective node representations by recursively aggregating information from graph neighborhoods. While GNNs can be trained from scratch, pre-training GNNs to learn transferable knowledge for downstream tasks has recently been demonstrated to improve the state of the art. However, conventional GNN pre-training methods follow a two-step paradigm: 1) pre-training on abundant unlabeled data and 2) fine-tuning on downstream labeled data, between which there exists a significant gap due to the divergence of optimization objectives in the two steps. In this paper, we conduct an analysis to show the divergence between pre-training and fine-tuning, and to alleviate such divergence, we propose L2P-GNN, a self-supervised pre-training strategy for GNNs. The key insight is that L2PGNN attempts to learn how to fine-tune during the pre-training process in the form of transferable prior knowledge. To encode both local and global information into the prior, L2P-GNN is further designed with a dual adaptation mechanism at both node and graph levels. Finally, we conduct a systematic empirical study on the pre-training of various GNN models, using both a public collection of protein graphs and a new compilation of bibliographic graphs for pre-training. Experimental results show that L2P-GNN is capable of learning effective and transferable prior knowledge that yields powerful representations for downstream tasks. (Code and datasets are available at https://github.com/rootlu/L2P-GNN.)
Keywords
pre-training, graph neural networks, meta-learning, MAML
Discipline
Databases and Information Systems | OS and Networks
Research Areas
Data Science and Engineering
Publication
Proceedings of the Thirty-Fifth AAAI Conference on Artificial Intelligence, Virtual Conference, 2021 February 2-9
Volume
35
First Page
4276
Last Page
4284
Publisher
AAAI
City or Country
Virtual Conference
Citation
LU, Yuanfu; JIANG, Xunqiang; FANG, Yuan; and SHI, Chuan.
Learning to pre-train graph neural networks. (2021). Proceedings of the Thirty-Fifth AAAI Conference on Artificial Intelligence, Virtual Conference, 2021 February 2-9. 35, 4276-4284.
Available at: https://ink.library.smu.edu.sg/sis_research/6125
Creative Commons License
This work is licensed under a Creative Commons Attribution-NonCommercial-No Derivative Works 4.0 International License.