OOD Detection
OOD: Out-of-Distribution
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10 papers in the last four weeks, up 11% on the four weeks before. 0.1% of all new papers.
Latest papers 145
``How long can I live and remain free of cancer?'' is often the first question a patient asks after receiving a cancer diagnosis and treatment. Accurate survival prediction helps alleviate psychological distress and supports risk stratification and personalized treatment planning. Recent survival prediction frameworks have shown strong performance using computed tomography (CT) images. However, variations in imaging acquisition introduce out-of-distribution (OOD) samples caused by covariate shifts that undermine model reliability. Despite this challenge, to our knowledge, no existing benchmark systematically studies OOD detection in cancer survival prediction. To address this gap, we introduce the Cancer sURvival bEnchmark for OOD Detection (CURE-OOD), the first benchmark for systematically evaluating OOD detection in survival prediction under controlled acquisition-induced distribution shifts. CURE-OOD defines scanner-parameter-based training, in-distribution (ID), and OOD test splits across four survival prediction tasks. Our experiments show that covariate shifts notably reduce survival prediction performance. It also shows that mainstream classification-oriented OOD detectors can fail in survival prediction. Finally, we include HazardDev as a simple survival-aware reference baseline for OOD detection. CURE-OOD enables systematic analysis of how distribution shifts affect both downstream survival performance and OOD detectability.
How Language Models Process Out-of-Distribution Inputs: A Two-Pathway Framework
Recent white-box OOD detection methods for LLMs -- including CED, RAUQ, and WildGuard confidence scores -- appear effective, but we show they are structurally confounded by sequence length (|r| >= 0.61) and collapse to near-chance under length-matched evaluation. Even raw attention entropy (mean H(alpha) across heads and layers), a natural baseline we include for completeness, shows the same confound. The confound stems from attention's Theta(log T) dependence on input length. To identify genuine OOD signals after deconfounding, we propose a two-pathway framework: embeddings capture what text is about (effective for topic shifts), while the processing trajectory -- hidden-state evolution across layers -- captures how the model processes input. The relative power of each pathway varies along a vocabulary-transparency spectrum: embedding methods excel on vocabulary-distinctive OOD, while trajectory features detect covert-intent inputs that share vocabulary with normal text (0.721 avg AUROC; Jailbreak: 0.850). Three evidence lines support this framework: (1) a crossover between k-NN and trajectory scoring across 6 tasks, where each pathway wins on different OOD types; (2) a per-layer analysis showing that layer-0 k-NN signal is almost entirely a length artifact (Jailbreak: 0.759 raw -> 0.389 matched) -- processing constructs genuine OOD signal from near-chance embeddings; and (3) circuit attribution showing adversarial tasks engage attention circuits more than semantic tasks (p = 0.022; Jailbreak patching p < 0.001), with partial cross-model replication. Code release upon publication.
Task-Conditioned Uncertainty Costmaps for Legged Locomotion
Legged robots maintain dynamic feasibility through multicontact interactions with terrain. Learned foothold prediction can provide feasibility-aware costs for motion planning and path selection, but accurately predicting future contacts from perceptual inputs such as height scans remains challenging on highly unstructured terrain, even with a repetitive gait cycle. In this work, we show that modeling epistemic uncertainty in predicted footholds, conditioned on terrain observations and commanded motion, distinguishes in-distribution from out-of-distribution operating regimes in simulation and real-world settings. This allows a single learned model, trained on limited data distributions, to express uncertainty caused by missing training coverage. We use this learned uncertainty to detect OOD regions and incorporate them into a unified costmap-generation framework for uncertainty-aware path planning. Using these uncertainty-aware costmaps, we evaluate feasibility error across in-distribution and OOD terrains in simulation and real-world settings. The results show improved OOD detection, up to a 37% reduction in simulation feasibility error, and more reliable planning behavior than geometry-only baselines.
Sparsity as a Key: Unlocking New Insights from Latent Structures for Out-of-Distribution Detection
Sparse Autoencoders (SAEs) have demonstrated significant success in interpreting Large Language Models (LLMs) by decomposing dense representations into sparse, semantic components. However, their potential for analyzing Vision Transformers (ViTs) remains largely under-explored. In this work, we present the first application of SAEs to the ViT [CLS] token for out-of-distribution (OOD) detection, addressing the limitation of existing methods that rely on entangled feature representations. We propose a novel framework utilizing a Top-k SAE to disentangle the dense [CLS] features into a structured latent space. Through this analysis, we reveal that in-distribution (ID) data exhibits consistent, class-specific activation patterns, which we formalize as Class Activation Profiles (CAPs). Our study uncovers a key structural invariant: while ID samples preserve a stable pattern within CAPs, OOD samples systematically disrupt this structure. Leveraging this insight, we introduce a scoring function based on the divergence of core energy profiles to quantify the deviation from ideal activation profiles. Our method achieves strong results on the FPR95 metric, critical for safety-sensitive applications across multiple benchmarks, while also achieving competitive AUROC. Overall, our findings demonstrate that the sparse, disentangled features revealed by SAEs can serve as a powerful, interpretable tool for robust OOD detection in vision models.
The Unseen Adversaries: Robust and Generalized Defense Against Adversarial Patches
The vulnerabilities of deep neural networks against singularities have raised serious concerns regarding their deployment in the physical world. One of the most prominent and impactful physical-world adversarial perturbations is the attachment of patches to clean images, known as an adversarial patch attack. Similarly, natural noises such as Gaussian and Salt&Pepper are highly prevalent in the real world. The current research need arises from the above vulnerabilities and the lack of efforts to tackle these two singularities independently and, especially, in combination. In this research, we have, for the first time, combined these two prominent singularities and proposed a novel dataset. Using this dataset, we have conducted a benchmark study of singularity data-point detection using features from several convolutional neural networks. For classification, rather than the popular neural network-based parameter tuning, we have used traditional yet effective machine learning classifiers. The extensive experiments across various in- and out-of-distribution (OOD) singularities reveal several interesting findings about the effectiveness of classifiers and show that it is hard to defend against adversaries when they are treated independently, and inefficient classifiers are selected.
DynProto: Dynamic Prototype Evolution for Out-of-Distribution Detection
Recent studies show that using potential out-of-distribution (OOD) labels from large corpora as auxiliary information can improve OOD detection in vision-language models (VLMs). However, these methods often fail when real-world OOD samples fall outside the predefined OOD label set. To address this limitation, we propose DynProto, a novel approach that learns OOD prototypes dynamically during testing using only in-distribution (ID) information. DynProto is inspired by a key observation: OOD samples predicted as the same ID class tend to cluster in the feature space. With this insight, we leverage easy-to-detect OOD samples as ``anchors'' to find their harder-to-detect, similar counterparts. To this end, DynProto introduces two modules: \textbf{Coarse OOD Pattern Capturing Module} caches OOD patterns that are easily confused with each ID class during testing, and \textbf{Fine-grained OOD Pattern Refinement Module} subsequently clusters these patterns within each cache and aggregates them into representative OOD prototypes. By measuring similarity to ID and dynamic OOD prototypes, DynProto enables accurate OOD detection. DynProto significantly outperforms prior methods across multiple benchmarks. On ImageNet OOD benchmark, DynProto reduces FPR95 by 11.60% and improves AUROC by 4.70%. Moreover, the framework is architecture-agnostic and can be integrated into various backbones.
Learning to Identify Out-of-Distribution Objects for 3D LiDAR Anomaly Segmentation
Understanding the surrounding environment is fundamental in autonomous driving and robotic perception. Distinguishing between known classes and previously unseen objects is crucial in real-world environments, as done in Anomaly Segmentation. However, research in the 3D field remains limited, with most existing approaches applying post-processing techniques from 2D vision. To cover this lack, we propose a new efficient approach that directly operates in the feature space, modeling the feature distribution of inlier classes to constrain anomalous samples. Moreover, the only publicly available 3D LiDAR anomaly segmentation dataset contains simple scenarios, with few anomaly instances, and exhibits a severe domain gap due to its sensor resolution. To bridge this gap, we introduce a set of mixed real-synthetic datasets for 3D LiDAR anomaly segmentation, built upon established semantic segmentation benchmarks, with multiple out-of-distribution objects and diverse, complex environments. Extensive experiments demonstrate that our approach achieves state-of-the-art and competitive results on the existing real-world dataset and the newly introduced mixed datasets, respectively, validating the effectiveness of our method and the utility of the proposed datasets. Code and datasets are available at https://simom0.github.io/lido-page/.
Back to Source: Open-Set Continual Test-Time Adaptation via Domain Compensation
Test-Time Adaptation (TTA) aims to mitigate distributional shifts between training and test domains during inference time. However, existing TTA methods fall short in the realistic scenario where models face both continually changing domains and the simultaneous emergence of unknown semantic classes, a challenging setting we term Open-set Continual Test-Time Adaptation (OCTTA). The coupling of domain and semantic shifts often collapses the feature space, severely degrading both classification and out-of-distribution detection. To tackle this, we propose DOmain COmpensation (DOCO), a lightweight and effective framework that robustly performs domain adaptation and OOD detection in a synergistic, closed loop. DOCO first performs dynamic, adaptation-conditioned sample splitting to separate likely ID from OOD samples. Then, using only the ID samples, it learns a domain compensation prompt by aligning feature statistics with the source domain, guided by a structural preservation regularizer that prevents semantic distortion. This learned prompt is then propagated to the OOD samples within the same batch, effectively isolating their semantic novelty for more reliable detection. Extensive experiments on multiple challenging benchmarks demonstrate that DOCO outperforms prior CTTA and OSTTA methods, establishing a new state-of-the-art for the demanding OCTTA setting.
Component-Based Out-of-Distribution Detection
Out-of-Distribution (OOD) detection requires sensitivity to subtle shifts without overreacting to natural In-Distribution (ID) diversity. However, from the viewpoint of detection granularity, global representation inevitably suppress local OOD cues, while patch-based methods are unstable due to entangled spurious-correlation and noise. And neither them is effective in detecting compositional OODs composed of valid ID components. Inspired by recognition-by-components theory, we present a training-free Component-Based OOD Detection (CoOD) framework that addresses the existing limitations by decomposing inputs into functional components. To instantiate CoOD, we derive Component Shift Score (CSS) to detect local appearance shifts, and Compositional Consistency Score (CCS) to identify cross-component compositional inconsistencies. Empirically, CoOD achieves consistent improvements on both coarse- and fine-grained OOD detection.
TTL: Test-time Textual Learning for OOD Detection with Pretrained Vision-Language Models
Vision-language models (VLMs) such as CLIP exhibit strong Out-of-distribution (OOD) detection capabilities by aligning visual and textual representations. Recent CLIP-based test-time adaptation methods further improve detection performance by incorporating external OOD labels. However, such labels are finite and fixed, while the real OOD semantic space is inherently open-ended. Consequently, fixed labels fail to represent the diverse and evolving OOD semantics encountered in test streams. To address this limitation, we introduce Test-time Textual Learning (TTL), a framework that dynamically learns OOD textual semantics from unlabeled test streams, without relying on external OOD labels. TTL updates learnable prompts using pseudo-labeled test samples to capture emerging OOD knowledge. To suppress noise introduced by pseudo-labels, we introduce an OOD knowledge purification strategy that selects reliable OOD samples for adaptation while suppressing noise. In addition, TTL maintains an OOD Textual Knowledge Bank that stores high-quality textual features, providing stable score calibration across batches. Extensive experiments on two standard benchmarks with nine OOD datasets demonstrate that TTL consistently achieves state-of-the-art performance, highlighting the value of textual adaptation for robust test-time OOD detection. Our code is available at https://github.com/figec/TTL.
Ranked Activation Shift for Post-Hoc Out-of-Distribution Detection
State-of-the-art post-hoc out-of-distribution detection methods rely on intermediate layer activation editing. However, they exhibit inconsistent performance across datasets and models. We show that this instability is driven by differences in the activation distributions, and identify a failure mode of scaling-based methods that arises when penultimate layer activations are not rectified. Motivated by this analysis, we propose RAS, a hyperparameter-free post-hoc method that replaces sorted activation magnitudes with a fixed in-distribution reference profile. Our simple plug-and-play method shows strong and consistent performance across datasets and architectures without assumptions on the penultimate layer activation function, and without requiring any hyperparameter tuning, while empirically preserving in-distribution classification accuracy. We further analyze what drives the improvement, showing that both inhibiting and exciting activation shifts independently contribute to better out-of-distribution discrimination.
T-QPM: Enabling Temporal Out-Of-Distribution Detection and Domain Generalization for Vision-Language Models in Open-World
Out-of-distribution (OOD) detection remains a critical challenge in open-world learning, where models must adapt to evolving data distributions. While recent vision-language models (VLMS) like CLIP enable multimodal OOD detection through Dual-Pattern Matching (DPM), existing methods typically suffer from two major shortcomings: (1) They rely on fixed fusion rules and assume static environments, failing under temporal drift; and (2) they lack robustness against covariate shifted inputs. In this paper, we propose a novel two-step framework to enhance OOD detection and covariate distribution shift robustness in dynamic settings. We extend the dual-pattern regime into Temporal Quadruple-Pattern Matching (T-QPM). First, by pairing OOD images with text descriptions, we introduce cross-modal consistency patterns between ID and OOD signals, refining the decision boundary through joint image-text reasoning. Second, we address temporal distribution shifts by learning lightweight fusion weights to optimally combine semantic matching and visual typicality. To ensure stability, we enforce explicit regularization based on Average Thresholded Confidence (ATC), preventing performance degradation as distributions evolve. Experiments on temporally partitioned benchmarks demonstrate that our approach significantly outperforms static baselines, offering a robust, temporally-consistent framework for multimodal OOD detection in non-stationary environments.
ProtoDCS: Towards Robust and Efficient Open-Set Test-Time Adaptation for Vision-Language Models
Large-scale Vision-Language Models (VLMs) exhibit strong zero-shot recognition, yet their real-world deployment is challenged by distribution shifts. While Test-Time Adaptation (TTA) can mitigate this, existing VLM-based TTA methods operate under a closed-set assumption, failing in open-set scenarios where test streams contain both covariate-shifted in-distribution (csID) and out-of-distribution (csOOD) data. This leads to a critical difficulty: the model must discriminate unknown csOOD samples to avoid interference while simultaneously adapting to known csID classes for accuracy. Current open-set TTA (OSTTA) methods rely on hard thresholds for separation and entropy minimization for adaptation. These strategies are brittle, often misclassifying ambiguous csOOD samples and inducing overconfident predictions, and their parameter-update mechanism is computationally prohibitive for VLMs. To address these limitations, we propose Prototype-based Double-Check Separation (ProtoDCS), a robust framework for OSTTA that effectively separates csID and csOOD samples, enabling safe and efficient adaptation of VLMs to csID data. Our main contributions are: (1) a novel double-check separation mechanism employing probabilistic Gaussian Mixture Model (GMM) verification to replace brittle thresholding; and (2) an evidence-driven adaptation strategy utilizing uncertainty-aware loss and efficient prototype-level updates, mitigating overconfidence and reducing computational overhead. Extensive experiments on CIFAR-10/100-C and Tiny-ImageNet-C demonstrate that ProtoDCS achieves state-of-the-art performance, significantly boosting both known-class accuracy and OOD detection metrics. Code will be available at https://github.com/O-YangF/ProtoDCS.
Native Extrapolation Awareness in Flow-Based Conditional Generation
The ability of Flow Matching (FM) to model complex conditional distributions has established it as the state-of-the-art for prediction tasks (e.g., robotics, weather forecasting). However, deployment in safety-critical settings is hindered by a critical extrapolation hazard: driven by smoothness biases, flow models yield plausible outputs even for off-manifold conditions, resulting in silent failures indistinguishable from valid predictions. In this work, we introduce Diverging Flows, a novel approach that enables a single model to simultaneously perform conditional generation and native extrapolation detection by structurally enforcing inefficient transport for off-manifold inputs. We evaluate our method on synthetic manifolds, cross-domain style transfer, and weather temperature forecasting, demonstrating that it achieves effective detection of extrapolations without compromising predictive fidelity or inference latency. These results establish Diverging Flows as a robust solution for trustworthy flow models, paving the way for reliable deployment in domains such as medicine, robotics, and climate science.
Toxicity Assessment in Preclinical Histopathology via Class-Aware Mahalanobis Distance for Known and Novel Anomalies
Drug-induced toxicity is a leading cause of preclinical and early-clinical failure, making early detection critical. Histopathology is the gold standard for toxicity assessment but relies on expert pathologists, creating a bottleneck for large-scale screening. We introduce an AI-based anomaly detection framework for whole-slide images (WSIs) of rodent liver that identifies healthy tissue and known pathologies (anomalies) and flags samples without training data as out-of-distribution (OOD). We evaluate OOD detection on two held-out categories: apoptosis (single-cell, near-OOD) and staining/processing artifacts (heterogeneous, far-OOD). We build a novel pixelwise-annotated dataset and fine-tune a pre-trained Vision Transformer (DINOv2) via Low-Rank Adaptation (LoRA) for segmentation, then use the Mahalanobis distance for OOD detection with class-specific thresholds. Optimizing the false positive rate subject to a predefined constraint on the false negative rate yields only 0.16% of pathological tissue classified as healthy and 0.35% of healthy tissue classified as pathological. Our false negative rate does not penalise cross-type errors, reflecting the safety-first objective of never overlooking a lesion; under the stricter correct-class criterion our method assigns 93.93% of ID and 89.38% of OOD findings to their own class. The study demonstrates technical feasibility of pixel-level anomaly detection for mouse liver histopathology, indicating possible applications in improving preclinical workflows and drug development efficiency.
Density-Informed Pseudo-Counts for Calibrated Evidential Deep Learning
Evidential Deep Learning (EDL) is a popular framework for uncertainty-aware classification that models predictive uncertainty via Dirichlet distributions parameterized by neural networks. Despite its popularity, its theoretical foundations and behavior under distributional shift remain poorly understood. In this work, we provide a principled statistical interpretation by proving that EDL training corresponds to amortized variational inference in a hierarchical Bayesian model with a tempered pseudo-likelihood. This perspective reveals a major drawback: standard EDL conflates epistemic and aleatoric uncertainty, leading to systematic overconfidence on out-of-distribution (OOD) inputs. To address this, we introduce Density-Informed Pseudo-count EDL (DIP-EDL), a new parametrization that decouples class prediction from the magnitude of uncertainty by separately estimating the conditional label distribution and the marginal covariate density. This separation preserves evidence in high-density regions while shrinking predictions toward a uniform prior for OOD data. Theoretically, we prove that DIP-EDL achieves asymptotic concentration. Empirically, we show that our method enhances interpretability and improves robustness and uncertainty calibration under distributional shift.
Out-of-Distribution Detection in Molecular Complexes via Diffusion Models for Irregular Graphs
Predictive machine learning models generally excel on in-distribution data, but their performance degrades on out-of-distribution (OOD) inputs. Reliable deployment therefore requires robust OOD detection, yet this is particularly challenging for irregular 3D graphs that combine continuous geometry with categorical identities and are unordered by construction. Here, we present a probabilistic OOD detection framework for complex 3D graph data built on a diffusion model that learns a density of the training distribution in a fully unsupervised manner. A key ingredient we introduce is a unified continuous diffusion over both 3D coordinates and discrete features: categorical identities are embedded in a continuous space and trained with cross-entropy, while the corresponding diffusion score is obtained analytically via posterior-mean interpolation from predicted class probabilities. This yields a single self-consistent probability-flow ODE (PF-ODE) that produces per-sample log-likelihoods, providing a principled typicality score for distribution shift. We validate the approach on protein-ligand complexes and construct strict OOD datasets by withholding entire protein families from training. PF-ODE likelihoods identify held-out families as OOD and correlate strongly with prediction errors of an independent binding-affinity model (GEMS), enabling a priori reliability estimates on new complexes. Beyond scalar likelihoods, we show that multi-scale PF-ODE trajectory statistics - including path tortuosity, flow stiffness, and vector-field instability - provide complementary OOD information. Modeling the joint distribution of these trajectory features yields a practical, high-sensitivity detector that improves separation over likelihood-only baselines, offering a label-free OOD quantification workflow for geometric deep learning.
Medix: Out-of-Distribution Detection from Unlabeled Wild Data via Robust Gradient Statistics
Out-of-distribution (OOD) detection plays a crucial role in ensuring the robustness of machine learning systems deployed in real-world applications. Recent approaches have explored the use of unlabeled data, showing potential for enhancing OOD detection capabilities. However, effectively utilizing unlabeled in-the-wild data remains challenging due to the mixed nature of both in-distribution (InD) and OOD samples. The lack of a distinct set of OOD samples complicates the task of training an optimal OOD classifier. In this work, we introduce Medix, a novel framework designed to identify potential outliers from unlabeled data using the median-based robust gradient statistics. We use the median because it provides a stable estimate of the central tendency, as an OOD detection mechanism, due to its robustness against noise and outliers. Using these identified outliers, along with labeled InD data, we train a robust OOD classifier. From a theoretical perspective, we derive error bounds that demonstrate Medix achieves a low error rate. Empirical results further substantiate our claims, as Medix outperforms existing methods across the board in open-world settings.
Uncertainty-Aware Ankle Exoskeleton Control
Lower limb exoskeletons show promise to assist human movement, but their utility is limited by controllers designed for discrete, predefined actions in controlled environments, restricting their real-world applicability. We present an uncertainty-aware control framework that enables ankle exoskeletons to operate safely across diverse scenarios by automatically disengaging when encountering unfamiliar movements. Our approach uses an uncertainty estimator to classify movements as similar (in-distribution) or different (out-of-distribution) relative to actions in the training set. We evaluated three architectures (model ensembles, autoencoders, and generative adversarial networks) on an offline dataset and tested the strongest performing architecture (ensemble of gait phase estimators) online. The online test demonstrated the ability of our uncertainty estimator to turn assistance on and off as the user transitioned between in-distribution and out-of-distribution tasks (F1: 89.2). This new framework provides a path for exoskeletons to safely and autonomously support human movement in unstructured, everyday environments.
Out-of-Distribution Detection using Counterfactual Distance
Accurate and explainable out-of-distribution (OOD) detection is required to use machine learning systems safely. Previous work has shown that feature distance to decision boundaries can be used to identify OOD data effectively. In this paper, we build on this intuition and propose a post-hoc OOD detection method that, given an input, calculates the distance to decision boundaries by leveraging counterfactual explanations. Since computing explanations can be expensive for large architectures, we also propose strategies to improve scalability by computing counterfactuals directly in embedding space. Crucially, as the method employs counterfactual explanations, we can seamlessly use them to help interpret the results of our detector. We show that our method is in line with the state of the art on CIFAR-10, achieving 93.50% AUROC and 25.80% FPR95. Our method outperforms these methods on CIFAR-100 with 97.05% AUROC and 13.79% FPR95 and on ImageNet-200 with 92.55% AUROC and 33.55% FPR95 across four OOD datasets
Knowing When Not to Answer: Lightweight KB-Aligned OOD Detection for Safe RAG
Retrieval-Augmented Generation (RAG) systems are increasingly deployed in high-stakes domains, where safety depends not only on how a system answers, but also on whether a query should be answered given a knowledge base (KB). Out-of-domain (OOD) queries can cause dense retrieval to surface weakly related context and lead the generator to produce fluent but unjustified responses. We study lightweight, KB-aligned OOD detection as an always-on gate for RAG systems. Our approach applies PCA to KB embeddings and scores queries in a compact subspace selected either by explained-variance retention (EVR) or by a separability-driven t-test ranking. We evaluate geometric semantic-search rules and lightweight classifiers across 16 domains, including high-stakes COVID-19 and Substance Use KBs, and stress-test robustness using both LLM-generated attacks and an in-the-wild 4chan attack. We find that low-dimensional detectors achieve competitive OOD performance while being faster, cheaper, and more interpretable than prompted LLM-based judges. Finally, human and LLM-based evaluations show that OOD queries primarily degrade the relevance of RAG outputs, showing the need for efficient external OOD detection to maintain safe, in-scope behavior.
Last Layer Hamiltonian Monte Carlo
We explore the use of Hamiltonian Monte Carlo (HMC) sampling as a probabilistic last layer approach for deep neural networks (DNNs). While HMC is widely regarded as a gold standard for uncertainty estimation, the computational demands limit its application to large-scale datasets and large DNN architectures. Although the predictions from the sampled DNN parameters can be parallelized, the computational cost still scales linearly with the number of samples (similar to an ensemble). Last layer HMC (LL-HMC) reduces the required computations by restricting the HMC sampling to the final layer of a DNN, making it applicable to more data-intensive scenarios with limited computational resources. In this paper, we compare LL-HMC against five last layer probabilistic deep learning (LL-PDL) methods across three real-world video datasets for driver action and intention. We evaluate the in-distribution classification performance, calibration, and out-of-distribution (OOD) detection. Due to the stochastic nature of the probabilistic evaluations, we performed five grid searches for different random seeds to avoid being reliant on a single initialization for the hyperparameter configurations. The results show that LL-HMC achieves competitive in-distribution classification and OOD detection performance. Additional sampled last layer parameters do not improve the classification performance, but can improve the OOD detection. Multiple chains or starting positions did not yield consistent improvements.
Kernel PCA for Out-of-Distribution Detection: Non-Linear Kernel Selection and Approximation
Out-of-Distribution (OoD) detection is vital for the reliability of deep neural networks, the key of which lies in effectively characterizing the disparities between OoD and In-Distribution (InD) data. In this work, such disparities are exploited through a fresh perspective of non-linear feature subspace. That is, a discriminative non-linear subspace is learned from InD features to capture representative patterns of InD, while informative patterns of OoD features cannot be well captured in such a subspace due to their different distribution. Grounded on this perspective, we exploit the deviations of InD and OoD features in such a non-linear subspace for effective OoD detection. To be specific, we leverage the framework of Kernel Principal Component Analysis (KPCA) to attain the discriminative non-linear subspace and deploy the reconstruction error on such subspace to distinguish InD and OoD data. Two challenges emerge: (i) the learning of an effective non-linear subspace, i.e., the selection of kernel function in KPCA, and (ii) the computation of the kernel matrix with large-scale InD data. For the former, we reveal two vital non-linear patterns that closely relate to the InD-OoD disparity, leading to the establishment of a Cosine-Gaussian kernel for constructing the subspace. For the latter, we introduce two techniques to approximate the Cosine-Gaussian kernel with significantly cheap computations. In particular, our approximation is further tailored by incorporating the InD data confidence, which is demonstrated to promote the learning of discriminative subspaces for OoD data. Our study presents new insights into the non-linear feature subspace for OoD detection and contributes practical explorations on the associated kernel design and efficient computations, yielding a KPCA detection method with distinctively improved efficacy and efficiency.
Beyond Perceptual Distance: Discrepancy Assessment on Deep Representation for Out-of-Distribution Detection with Diffusion Model
Out-of-Distribution (OoD) detection aims to justify whether a given sample is from the training distribution of the classifier-under-protection, i.e., In-Distribution (InD), or from an unknown out distribution. Recent researches have leveraged Diffusion Models (DMs) for OoD detection due to their powerful distribution modeling capability. Given an input image, an InD-pretrained DM produces a corresponding InD-aligned counterpart, which serves as a generative reference for comparison. However, existing DM-based methods typically assess this underlying discrepancy through visual-level distances in the raw image space, which may be misaligned with the distributional discrepancy relevant to OoD detection. In this work, we investigate the fundamentals of discrepancy assessment in DM-based OoD detection, asking how the discrepancy between an input and its DM-generated counterpart should be formulated, and in which representation spaces and with which metrics it should be measured. To this end, we propose to assess the discrepancy in a classifier-relative manner by exploiting the representation spaces of the classifier-under-protection, whose training on InD data encodes rich task-relevant InD knowledge. In particular, we quantify two types of discrepancy: feature-level covariate discrepancy in deep feature representations and logit-level concept discrepancy in output logits, enabling effective differentiation between InD and OoD samples. Moreover, a subspace-based strategy is devised to refine representations of the DM generation to promote discrepancy assessment. Together, these designs form our novel detection framework, namely DDR. Extensive experiments on the challenging large-scale ImageNet-1K dataset demonstrate the superior detection performance of DDR over both DM-based and non-DM-based methods.
Optimizing Three Critical Factors for Practical and Effective OOD Detection Fine-Tuning
In out-of-distribution (OOD) detection, fine-tuning with auxiliary outlier data often improves detection performance at the cost of classification accuracy. This trade-off stems from the loss of the original in-distribution (ID) distribution during fine-tuning. To establish a more practical and effective paradigm, we optimize three critical factors: model reminder, data sampling, and representation learning. We propose: (1) Self-Knowledge Distillation (SKD) to mitigate accuracy reduction; (2) Semi-hard Outlier Sampling (SOS) to improve detection efficiency with minimal data; and (3) Outlier-aware Supervised Contrastive Learning (OSCL) to promote ID-OOD separability. Optimizing these factors produces cumulative gains, boosting both OOD detection performance and classification accuracy. Our framework outperforms existing methods across diverse benchmarks, particularly in long-tailed scenarios, providing a robust baseline for real-world OOD detection.