Towards data-centric graph machine learning: Review and outlook

X Zheng, Y Liu, Z Bao, M Fang, X Hu, AWC Liew… - arXiv preprint arXiv …, 2023 - arxiv.org
Data-centric AI, with its primary focus on the collection, management, and utilization of data
to drive AI models and applications, has attracted increasing attention in recent years. In this …

Learning invariant graph representations for out-of-distribution generalization

H Li, Z Zhang, X Wang, W Zhu - Advances in Neural …, 2022 - proceedings.neurips.cc
Graph representation learning has shown effectiveness when testing and training graph
data come from the same distribution, but most existing approaches fail to generalize under …

Unleashing the power of graph data augmentation on covariate distribution shift

Y Sui, Q Wu, J Wu, Q Cui, L Li, J Zhou… - Advances in Neural …, 2024 - proceedings.neurips.cc
The issue of distribution shifts is emerging as a critical concern in graph representation
learning. From the perspective of invariant learning and stable learning, a recently well …

Good: A graph out-of-distribution benchmark

S Gui, X Li, L Wang, S Ji - Advances in Neural Information …, 2022 - proceedings.neurips.cc
Abstract Out-of-distribution (OOD) learning deals with scenarios in which training and test
data follow different distributions. Although general OOD problems have been intensively …

Handling distribution shifts on graphs: An invariance perspective

Q Wu, H Zhang, J Yan, D Wipf - arXiv preprint arXiv:2202.02466, 2022 - arxiv.org
There is increasing evidence suggesting neural networks' sensitivity to distribution shifts, so
that research on out-of-distribution (OOD) generalization comes into the spotlight …

Dynamic graph neural networks under spatio-temporal distribution shift

Z Zhang, X Wang, Z Zhang, H Li… - Advances in neural …, 2022 - proceedings.neurips.cc
Dynamic graph neural networks (DyGNNs) have demonstrated powerful predictive abilities
by exploiting graph structural and temporal dynamics. However, the existing DyGNNs fail to …

Demystifying structural disparity in graph neural networks: Can one size fit all?

H Mao, Z Chen, W Jin, H Han, Y Ma… - Advances in neural …, 2024 - proceedings.neurips.cc
Abstract Recent studies on Graph Neural Networks (GNNs) provide both empirical and
theoretical evidence supporting their effectiveness in capturing structural patterns on both …

Artificial intelligence for science in quantum, atomistic, and continuum systems

X Zhang, L Wang, J Helwig, Y Luo, C Fu, Y Xie… - arXiv preprint arXiv …, 2023 - arxiv.org
Advances in artificial intelligence (AI) are fueling a new paradigm of discoveries in natural
sciences. Today, AI has started to advance natural sciences by improving, accelerating, and …

Sizeshiftreg: a regularization method for improving size-generalization in graph neural networks

D Buffelli, P Liò, F Vandin - Advances in Neural Information …, 2022 - proceedings.neurips.cc
In the past few years, graph neural networks (GNNs) have become the de facto model of
choice for graph classification. While, from the theoretical viewpoint, most GNNs can operate …

Alleviating structural distribution shift in graph anomaly detection

Y Gao, X Wang, X He, Z Liu, H Feng… - Proceedings of the …, 2023 - dl.acm.org
Graph anomaly detection (GAD) is a challenging binary classification problem due to its
different structural distribution between anomalies and normal nodes---abnormal nodes are …