The success of Graph Neural Networks (GNNs) has led to a need for understanding their decision-making process and providing explanations for their predictions, which has given rise to explainable AI (XAI) that offers transparent explanations for black-box models. Recently, the use of prototypes has successfully improved the explainability of models by learning prototypes to imply training graphs that affect the prediction. However, these approaches tend to provide prototypes with excessive information from the entire graph, leading to the exclusion of key substructures or the inclusion of irrelevant substructures, which can limit both the interpretability and the performance of the model in downstream tasks. In this work, we propose a novel framework of explainable GNNs, called interpretable Prototype-based Graph Information Bottleneck (PGIB), that incorporates prototype learning within the information bottleneck framework to provide prototypes with the key subgraph from the input graph that is important for the model prediction. This is the first work that incorporates prototype learning into the process of identifying the key subgraphs that have a critical impact on the prediction performance. Extensive experiments, including qualitative analysis, demonstrate that PGIB outperforms state-of-the-art methods in terms of both prediction performance and explainability.

We show that if the conditional distribution p(C | T) factors through a sufficient statistic ϕ(T), then the Information Bottleneck (IB) problem for (T, C) is exactly equivalent to the IB problem for (ϕ(T), C). The reduction is loss-free: it preserves the full IB curve, the Lagrangian optimum at every trade-off parameter \b{eta}, and the optimal representations up to pullback through ϕ. As a result, the computational complexity of solving the IB problem is governed by the dimension of the sufficient statistic rather than the ambient dimension of the source. This identifies an exact structural condition under which the generic IB problem becomes tractable, and gives a formal bridge between the discrete and linear-Gaussian regimes. We then show that the classical Gaussian IB solution of Chechik, Globerson, Tishby and Weiss is an immediate corollary of this reduction, and we state a nonlinear-Gaussian generalisation. A small numerical example illustrates the practical consequence: when a low-dimensional sufficient statistic is available, the exact IB curve can be computed on the reduced problem at a cost determined by the statistic rather than by the ambient source dimension.

Many unsupervised methods have recently been proposed for multivariate time series anomaly detection. However, existing works mainly focus on stable data yet often omit the drift generated from non-stationary environments, which may lead to numerous false alarms. We propose Dynamic Decomposition with Diffusion Reconstruction (D3R), a novel anomaly detection network for real-world unstable data to fill the gap. D3R tackles the drift via decomposition and reconstruction. In the decomposition procedure, we utilize data-time mix-attention to dynamically decompose long-period multivariate time series, overcoming the limitation of the local sliding window.

The invariance principle from causality is at the heart of notable approaches such as invariant risk minimization (IRM) that seek to address out-of-distribution (OOD) generalization failures. Despite the promising theory, invariance principle-based approaches fail in common classification tasks, where invariant (causal) features capture all the information about the label. Are these failures due to the methods failing to capture the invariance? Or is the invariance principle itself insufficient? To answer these questions, we revisit the fundamental assumptions in linear regression tasks, where invariance-based approaches were shown to provably generalize OOD. In contrast to the linear regression tasks, we show that for linear classification tasks we need much stronger restrictions on the distribution shifts, or otherwise OOD generalization is impossible. Furthermore, even with appropriate restrictions on distribution shifts in place, we show that the invariance principle alone is insufficient. We prove that a form of the information bottleneck constraint along with invariance helps address key failures when invariant features capture all the information about the label and also retains the existing success when they do not. We propose an approach that incorporates both of these principles and demonstrate its effectiveness in several experiments.

We investigate the HSIC (Hilbert-Schmidt independence criterion) bottleneck as a regularizer for learning an adversarially robust deep neural network classifier. In addition to the usual cross-entropy loss, we add regularization terms for every intermediate layer to ensure that the latent representations retain useful information for output prediction while reducing redundant information. We show that the HSIC bottleneck enhances robustness to adversarial attacks both theoretically and experimentally. In particular, we prove that the HSIC bottleneck regularizer reduces the sensitivity of the classifier to adversarial examples. Our experiments on multiple benchmark datasets and architectures demonstrate that incorporating an HSIC bottleneck regularizer attains competitive natural accuracy and improves adversarial robustness, both with and without adversarial examples during training. Our code and adversarially robust models are publicly available.2