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Systematic, compositional generalization beyond the training distribution remains a core challenge in machine learning -- and a critical bottleneck for the emergent reasoning abilities of modern language models. This work investigates…

Machine Learning · Computer Science 2025-10-17 Awni Altabaa , Siyu Chen , John Lafferty , Zhuoran Yang

LLMs show remarkable emergent abilities, such as inferring concepts from presumably out-of-distribution prompts, known as in-context learning. Though this success is often attributed to the Transformer architecture, our systematic…

Computation and Language · Computer Science 2024-10-25 Anna Mészáros , Szilvia Ujváry , Wieland Brendel , Patrik Reizinger , Ferenc Huszár

Large language models (LLMs) have achieved remarkable proficiency on solving diverse problems. However, their generalization ability is not always satisfying and the generalization problem is common for generative transformer models in…

Machine Learning · Computer Science 2024-08-20 Xingcheng Xu , Zihao Pan , Haipeng Zhang , Yanqing Yang

Out-of-distribution generalization (OODG) is a longstanding challenge for neural networks. This challenge is quite apparent in tasks with well-defined variables and rules, where explicit use of the rules could solve problems independently…

Machine Learning · Computer Science 2022-12-14 Andrew J. Nam , Mustafa Abdool , Trevor Maxfield , James L. McClelland

Out-of-distribution (OOD) generalisation is considered a hallmark of human and animal intelligence. To achieve OOD through composition, a system must discover the environment-invariant properties of experienced input-output mappings and…

Machine Learning · Computer Science 2025-05-19 George Dimitriadis , Spyridon Samothrakis

Modern foundation models exhibit remarkable out-of-distribution (OOD) generalization, solving tasks far beyond the support of their training data. However, the theoretical principles underpinning this phenomenon remain elusive. This paper…

Machine Learning · Statistics 2025-05-29 Jiawei Ge , Amanda Wang , Shange Tang , Chi Jin

Graphs are a fundamental data structure for representing relational information in domains such as social networks, molecular systems, and knowledge graphs. However, graph learning models often suffer from limited generalization when…

Machine Learning · Computer Science 2026-01-30 Haoyang Li , Haibo Chen , Xin Wang , Wenwu Zhu

Traditional machine learning paradigms are based on the assumption that both training and test data follow the same statistical pattern, which is mathematically referred to as Independent and Identically Distributed ($i.i.d.$). However, in…

Machine Learning · Computer Science 2023-07-28 Jiashuo Liu , Zheyan Shen , Yue He , Xingxuan Zhang , Renzhe Xu , Han Yu , Peng Cui

Chess is a canonical example of a task that requires rigorous reasoning and long-term planning. Modern decision Transformers - trained similarly to LLMs - are able to learn competent gameplay, but it is unclear to what extent they truly…

Machine Learning · Computer Science 2025-10-24 Anna Mészáros , Patrik Reizinger , Ferenc Huszár

Large language models (LLMs) based on the Transformer have demonstrated strong performance across diverse tasks. However, current models still exhibit substantial limitations in out-of-distribution (OOD) generalization compared with humans.…

Machine Learning · Computer Science 2026-02-02 Huanyu Liu , Ge Li , Yihong Dong , Sihan Wu , Peixu Wang , Sihao Cheng , Taozhi Chen , Kechi Zhang , Hao Zhu , Tongxuan Liu

Out-of-distribution (OOD) detection is essential for reliable and trustworthy machine learning. Recent multi-modal OOD detection leverages textual information from in-distribution (ID) class names for visual OOD detection, yet it currently…

Computation and Language · Computer Science 2023-10-13 Yi Dai , Hao Lang , Kaisheng Zeng , Fei Huang , Yongbin Li

Out-of-distribution (O.O.D.) generalization remains to be a key challenge for real-world machine learning systems. We describe a method for O.O.D. generalization that, through training, encourages models to only preserve features in the…

Machine Learning · Computer Science 2022-08-09 Arjun Ashok , Chaitanya Devaguptapu , Vineeth Balasubramanian

Machine learning (ML) systems in natural language processing (NLP) face significant challenges in generalizing to out-of-distribution (OOD) data, where the test distribution differs from the training data distribution. This poses important…

Computation and Language · Computer Science 2023-05-24 Linyi Yang , Yaoxiao Song , Xuan Ren , Chenyang Lyu , Yidong Wang , Lingqiao Liu , Jindong Wang , Jennifer Foster , Yue Zhang

The transformer's remarkable ability to perform in-context learning (ICL) has sparked a wide range of studies designed to understand its strengths and limitations. However, a theoretical understanding of when ICL can and cannot generalize…

Machine Learning · Statistics 2026-04-30 Soo Min Kwon , Alec S. Xu , Can Yaras , Laura Balzano , Qing Qu

Graph machine learning has been extensively studied in both academia and industry. Although booming with a vast number of emerging methods and techniques, most of the literature is built on the in-distribution hypothesis, i.e., testing and…

Machine Learning · Computer Science 2023-01-02 Haoyang Li , Xin Wang , Ziwei Zhang , Wenwu Zhu

Out-of-distribution (OOD) detection plays a vital role in enhancing the reliability of machine learning (ML) models. The emergence of large language models (LLMs) has catalyzed a paradigm shift within the ML community, showcasing their…

Computation and Language · Computer Science 2024-04-17 Bo Liu , Liming Zhan , Zexin Lu , Yujie Feng , Lei Xue , Xiao-Ming Wu

Detecting out-of-distribution (OOD) samples is crucial for ensuring the safety of machine learning systems and has shaped the field of OOD detection. Meanwhile, several other problems are closely related to OOD detection, including anomaly…

Computer Vision and Pattern Recognition · Computer Science 2025-06-19 Atsuyuki Miyai , Jingkang Yang , Jingyang Zhang , Yifei Ming , Yueqian Lin , Qing Yu , Go Irie , Shafiq Joty , Yixuan Li , Hai Li , Ziwei Liu , Toshihiko Yamasaki , Kiyoharu Aizawa

Out-of-distribution (OOD) generalization is challenging because distribution shifts come in many forms. Numerous algorithms exist to address specific settings, but choosing the right training algorithm for the right dataset without trial…

Machine Learning · Computer Science 2025-06-03 Liangze Jiang , Damien Teney

Pretrained large generative language models have shown great performance on many tasks, but exhibit low compositional generalization abilities. Scaling such models has been shown to improve their performance on various NLP tasks even just…

Computation and Language · Computer Science 2022-11-17 Arian Hosseini , Ankit Vani , Dzmitry Bahdanau , Alessandro Sordoni , Aaron Courville

Chain-of-Thought (CoT) training has markedly advanced the reasoning capabilities of large language models (LLMs), yet the mechanisms by which CoT training enhances generalization remain inadequately understood. In this work, we demonstrate…

Machine Learning · Computer Science 2026-02-13 Xinhao Yao , Ruifeng Ren , Yun Liao , Lizhong Ding , Yong Liu
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