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Adversarial Label Invariant Graph Data Augmentations for Out-of-Distribution Generalization

Machine Learning 2026-04-22 v2 Machine Learning

Abstract

Out-of-distribution (OoD) generalization occurs when representation learning encounters a distribution shift. This occurs frequently in practice when training and testing data come from different environments. Covariate shift is a type of distribution shift that occurs only in the input data, while the concept distribution stays invariant. We propose RIA - Regularization for Invariance with Adversarial training, a new method for OoD generalization under convariate shift. Motivated by an analogy to QQ-learning, it performs an adversarial exploration for counterfactual data environments. These new environments are induced by adversarial label invariant data augmentations that prevent a collapse to an in-distribution trained learner. It works with many existing OoD generalization methods for covariate shift that can be formulated as constrained optimization problems. We develop an alternating gradient descent-ascent algorithm to solve the problem in the context of causally generated graph data, and perform extensive experiments on OoD graph classification for various kinds of synthetic and natural distribution shifts. We demonstrate that our method can achieve high accuracy compared with OoD baselines.

Keywords

Cite

@article{arxiv.2604.08404,
  title  = {Adversarial Label Invariant Graph Data Augmentations for Out-of-Distribution Generalization},
  author = {Simon Zhang and Ryan P. DeMilt and Kun Jin and Cathy H. Xia},
  journal= {arXiv preprint arXiv:2604.08404},
  year   = {2026}
}

Comments

22 pages, 3 figures, accepted at ICML SCIS 2023

R2 v1 2026-07-01T12:01:27.260Z