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Recent work on neural algorithmic reasoning has investigated the reasoning capabilities of neural networks, effectively demonstrating they can learn to execute classical algorithms on unseen data coming from the train distribution. However,…

In the past decades, machine learning with Empirical Risk Minimization (ERM) has demonstrated great capability in learning and exploiting the statistical patterns from data, or even surpassing humans. Despite the success, ERM avoids the…

Machine Learning · Computer Science 2025-06-17 Yongqiang Chen

The rising need for explainable deep neural network architectures has utilized semantic concepts as explainable units. Several approaches utilizing disentangled representation learning estimate the generative factors and utilize them as…

Machine Learning · Computer Science 2024-10-22 Sanchit Sinha , Guangzhi Xiong , Aidong Zhang

Learning on molecule graphs has become an increasingly important topic in AI for science, which takes full advantage of AI to facilitate scientific discovery. Existing solutions on modeling molecules utilize Graph Neural Networks (GNNs) to…

Machine Learning · Computer Science 2025-05-13 Limin Li , Kuo Yang , Wenjie Du , Pengkun Wang , Zhengyang Zhou , Yang Wang

We introduce a new approach to functional causal modeling from observational data, called Causal Generative Neural Networks (CGNN). CGNN leverages the power of neural networks to learn a generative model of the joint distribution of the…

Most classification and segmentation datasets assume a closed-world scenario in which predictions are expressed as distribution over a predetermined set of visual classes. However, such assumption implies unavoidable and often unnoticeable…

Computer Vision and Pattern Recognition · Computer Science 2018-10-02 Petra Bevandić , Ivan Krešo , Marin Oršić , Siniša Šegvić

Out-of-distribution (OOD) detection remains challenging for deep learning models, particularly when test-time OOD samples differ significantly from training outliers. We propose OODD, a novel test-time OOD detection method that dynamically…

Computer Vision and Pattern Recognition · Computer Science 2025-03-14 Yifeng Yang , Lin Zhu , Zewen Sun , Hengyu Liu , Qinying Gu , Nanyang Ye

Detecting out-of-distribution (OOD) inputs is a central challenge for safely deploying machine learning models in the real world. Existing solutions are mainly driven by small datasets, with low resolution and very few class labels (e.g.,…

Computer Vision and Pattern Recognition · Computer Science 2021-05-06 Rui Huang , Yixuan Li

Existing methods for graph out-of-distribution (OOD) generalization primarily rely on empirical studies on synthetic datasets. Such approaches tend to overemphasize the causal relationships between invariant sub-graphs and labels, thereby…

Machine Learning · Computer Science 2025-07-08 Can Xu , Yao Cheng , Jianxiang Yu , Haosen Wang , Jingsong Lv , Yao Liu , Xiang Li

Causal representation learning has been proposed to encode relationships between factors presented in the high dimensional data. However, existing methods suffer from merely using a large amount of labeled data and ignore the fact that…

Machine Learning · Computer Science 2022-11-09 Jiageng Zhu , Hanchen Xie , Wael AbdAlmageed

The ability of an agent to do well in new environments is a critical aspect of intelligence. In machine learning, this ability is known as $\textit{strong}$ or $\textit{out-of-distribution}$ generalization. However, merely considering…

Machine Learning · Computer Science 2024-02-09 Siyuan Guo , Jonas Wildberger , Bernhard Schölkopf

Causal representation learning has emerged as the center of action in causal machine learning research. In particular, multi-domain datasets present a natural opportunity for showcasing the advantages of causal representation learning over…

Machine Learning · Computer Science 2023-12-12 Kartik Ahuja , Amin Mansouri , Yixin Wang

Out-of-distribution (OOD) detection is crucial for the reliable deployment of machine learning models in real-world scenarios, enabling the identification of unknown samples or objects. A prominent approach to enhance OOD detection…

Machine Learning · Statistics 2025-08-05 Heng Gao , Jun Li

As a pivotal component to attaining generalizable solutions in human intelligence, reasoning provides great potential for reinforcement learning (RL) agents' generalization towards varied goals by summarizing part-to-whole arguments and…

Machine Learning · Computer Science 2023-05-18 Wenhao Ding , Haohong Lin , Bo Li , Ding Zhao

Out-of-distribution (OOD) detection aims to discern outliers from the intended data distribution, which is crucial to maintaining high reliability and a good user experience. Most recent studies in OOD detection utilize the information from…

Computation and Language · Computer Science 2022-10-21 Hyunsoo Cho , Choonghyun Park , Jaewook Kang , Kang Min Yoo , Taeuk Kim , Sang-goo Lee

We develop a method for generating causal post-hoc explanations of black-box classifiers based on a learned low-dimensional representation of the data. The explanation is causal in the sense that changing learned latent factors produces a…

Machine Learning · Computer Science 2020-10-23 Matthew O'Shaughnessy , Gregory Canal , Marissa Connor , Mark Davenport , Christopher Rozell

Recent advancements have explored text-to-image diffusion models for synthesizing out-of-distribution (OOD) samples, substantially enhancing the performance of OOD detection. However, existing approaches typically rely on perturbing…

Computer Vision and Pattern Recognition · Computer Science 2025-10-28 Xin Gao , Jiyao Liu , Guanghao Li , Yueming Lyu , Jianxiong Gao , Weichen Yu , Ningsheng Xu , Liang Wang , Caifeng Shan , Ziwei Liu , Chenyang Si

In this study, we address causal inference when only observational data and a valid causal ordering from the causal graph are available. We introduce a set of flow models that can recover component-wise, invertible transformation of…

Machine Learning · Computer Science 2024-12-16 Minh Khoa Le , Kien Do , Truyen Tran

Out-of-distribution (OOD) generalization has attracted increasing research attention in recent years, due to its promising experimental results in real-world applications. In this paper,we study the confidence set prediction problem in the…

Machine Learning · Computer Science 2024-04-01 Xin Zou , Weiwei Liu

Graphical models can represent a multivariate distribution in a convenient and accessible form as a graph. Causal models can be viewed as a special class of graphical models that not only represent the distribution of the observed system…

Methodology · Statistics 2017-06-29 Christina Heinze-Deml , Marloes H. Maathuis , Nicolai Meinshausen