English
Related papers

Related papers: Structure-based out-of-distribution (OOD) material…

200 papers

Out-of-distribution (OOD) detection is essential for determining when a supervised model encounters inputs that differ meaningfully from its training distribution. While widely studied in classification, OOD detection for regression and…

Machine Learning · Statistics 2025-12-16 Min Lu , Hemant Ishwaran

During the forward pass of Deep Neural Networks (DNNs), inputs gradually transformed from low-level features to high-level conceptual labels. While features at different layers could summarize the important factors of the inputs at varying…

Machine Learning · Computer Science 2022-03-02 Haoliang Wang , Chen Zhao , Xujiang Zhao , Feng Chen

Out-of-distribution (OOD) detection is essential to prevent anomalous inputs from causing a model to fail during deployment. While improved OOD detection methods have emerged, they often rely on the final layer outputs and require a full…

Computer Vision and Pattern Recognition · Computer Science 2021-05-03 Ziqian Lin , Sreya Dutta Roy , Yixuan Li

Reinforcement Learning (RL) based solutions are being adopted in a variety of domains including robotics, health care and industrial automation. Most focus is given to when these solutions work well, but they fail when presented with out of…

Machine Learning · Computer Science 2021-12-07 Aaqib Parvez Mohammed , Matias Valdenegro-Toro

Deep neural networks (DNNs) often exhibit overconfidence when encountering out-of-distribution (OOD) samples, posing significant challenges for deployment. Since DNNs are trained on in-distribution (ID) datasets, the information flow of ID…

Computer Vision and Pattern Recognition · Computer Science 2025-04-07 Guide Yang , Chao Hou , Weilong Peng , Xiang Fang , Yongwei Nie , Peican Zhu , Keke Tang

Reliable out-of-distribution (OOD) detection is fundamental to implementing safer modern machine learning (ML) systems. In this paper, we introduce Igeood, an effective method for detecting OOD samples. Igeood applies to any pre-trained…

Machine Learning · Statistics 2022-03-16 Eduardo Dadalto Camara Gomes , Florence Alberge , Pierre Duhamel , Pablo Piantanida

Existing Out-of-Distribution (OoD) detection methods address to detect OoD samples from In-Distribution (InD) data mainly by exploring differences in features, logits and gradients in Deep Neural Networks (DNNs). We in this work propose a…

Machine Learning · Computer Science 2024-07-17 Kun Fang , Qinghua Tao , Xiaolin Huang , Jie Yang

Machine learning models often fail to generalize well under distributional shifts. Understanding and overcoming these failures have led to a research field of Out-of-Distribution (OOD) generalization. Despite being extensively studied for…

Deep learning systems deployed in real-world applications often encounter data that is different from their in-distribution (ID). A reliable model should ideally abstain from making decisions in this out-of-distribution (OOD) setting.…

Machine Learning · Computer Science 2025-10-02 Berker Demirel , Marco Fumero , Francesco Locatello

Machine learning (ML) models have emerged as powerful tools for accelerating materials discovery and design by enabling accurate predictions of properties from compositional and structural data. These capabilities are vital for developing…

Graph Neural Networks (GNNs) have achieved impressive performance in graph-related tasks. However, they suffer from poor generalization on out-of-distribution (OOD) data, as they tend to learn spurious correlations. Such correlations…

Machine Learning · Statistics 2026-03-26 Bowen Lu , Liangqiang Yang , Teng Li

Accurate prediction of physical properties is critical for discovering and designing novel materials. Machine learning technologies have attracted significant attention in the materials science community for their potential for large-scale…

Materials Science · Physics 2021-11-24 Boyu Zhang , Mushen Zhou , Jianzhong Wu , Fuchang Gao

Many real-world scenarios in which DNN-based recognition systems are deployed have inherently fine-grained attributes (e.g., bird-species recognition, medical image classification). In addition to achieving reliable accuracy, a critical…

Machine Learning · Computer Science 2022-10-21 Jingyang Zhang , Nathan Inkawhich , Randolph Linderman , Yiran Chen , Hai Li

In this paper, we tackle the detection of out-of-distribution (OOD) objects in semantic segmentation. By analyzing the literature, we found that current methods are either accurate or fast but not both which limits their usability in real…

Computer Vision and Pattern Recognition · Computer Science 2021-08-04 Victor Besnier , Andrei Bursuc , David Picard , Alexandre Briot

We present a theory for the construction of out-of-distribution (OOD) detection features for neural networks. We introduce random features for OOD through a novel information-theoretic loss functional consisting of two terms, the first…

Machine Learning · Computer Science 2025-06-18 Sudeepta Mondal , Zhuolin Jiang , Ganesh Sundaramoorthi

Deep neural networks are known to achieve superior results in classification tasks. However, it has been recently shown that they are incapable to detect examples that are generated by a distribution which is different than the one they…

Machine Learning · Computer Science 2019-12-09 Aristotelis-Angelos Papadopoulos , Nazim Shaikh , Mohammad Reza Rajati

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

Existing Visual-Language Models (VLMs) have achieved significant progress by being trained on massive-scale datasets, typically under the assumption that data are independent and identically distributed (IID). However, in real-world…

Computer Vision and Pattern Recognition · Computer Science 2026-02-23 Ling Lin , Yang Bai , Heng Su , Congcong Zhu , Yaoxing Wang , Yang Zhou , Huazhu Fu , Jingrun Chen

Out-of-distribution (OOD) detection aims to detect test samples outside the training category space, which is an essential component in building reliable machine learning systems. Existing reviews on OOD detection primarily focus on method…

Machine Learning · Computer Science 2025-08-05 Shuo Lu , Yingsheng Wang , Lijun Sheng , Lingxiao He , Aihua Zheng , Jian Liang

We characterized the generalization capabilities of DNN-based encoding models when predicting neuronal responses from the visual cortex. We collected \textit{MacaqueITBench}, a large-scale dataset of neural population responses from the…

Signal Processing · Electrical Eng. & Systems 2024-06-26 Spandan Madan , Will Xiao , Mingran Cao , Hanspeter Pfister , Margaret Livingstone , Gabriel Kreiman