Data-Augmented Curriculum Graph Neural Architecture Search under Distribution Shifts

Authors

  • Yang Yao Department of Computer Science and Technology, Tsinghua University
  • Xin Wang Department of Computer Science and Technology, Tsinghua University Beijing National Research Center for Information Science and Technology, Tsinghua University
  • Yijian Qin Department of Computer Science and Technology, Tsinghua University
  • Ziwei Zhang Department of Computer Science and Technology, Tsinghua University
  • Wenwu Zhu Department of Computer Science and Technology, Tsinghua University Beijing National Research Center for Information Science and Technology, Tsinghua University
  • Hong Mei MoE Key Lab of High Confidence Software Technologies, Peking University

DOI:

https://doi.org/10.1609/aaai.v38i15.29580

Keywords:

ML: Auto ML and Hyperparameter Tuning, ML: Graph-based Machine Learning

Abstract

Graph neural architecture search (NAS) has achieved great success in designing architectures for graph data processing.However, distribution shifts pose great challenges for graph NAS, since the optimal searched architectures for the training graph data may fail to generalize to the unseen test graph data. The sole prior work tackles this problem by customizing architectures for each graph instance through learning graph structural information, but failed to consider data augmentation during training, which has been proven by existing works to be able to improve generalization.In this paper, we propose Data-augmented Curriculum Graph Neural Architecture Search (DCGAS), which learns an architecture customizer with good generalizability to data under distribution shifts. Specifically, we design an embedding-guided data generator, which can generate sufficient graphs for training to help the model better capture graph structural information. In addition, we design a two-factor uncertainty-based curriculum weighting strategy, which can evaluate the importance of data in enabling the model to learn key information in real-world distribution and reweight them during training. Experimental results on synthetic datasets and real datasets with distribution shifts demonstrate that our proposed method learns generalizable mappings and outperforms existing methods.

Published

2024-03-24

How to Cite

Yao, Y., Wang, X., Qin, Y., Zhang, Z., Zhu, W., & Mei, H. (2024). Data-Augmented Curriculum Graph Neural Architecture Search under Distribution Shifts. Proceedings of the AAAI Conference on Artificial Intelligence, 38(15), 16433–16441. https://doi.org/10.1609/aaai.v38i15.29580

Issue

Section

AAAI Technical Track on Machine Learning VI