Unlabeled Data

In many prediction problems, we have extra information during training (for example, measurements that are expensive or slow to collect) that will not be available when the model is deployed. A common strategy is to first train a model that uses all training information, then use its predictions on unlabeled examples to train a second model that only uses the inputs available at test time. However, when the extra training-only information is weak or noisy, this Two-Stage approach can mislead the deployment model and even hurt accuracy. We propose a joint training method that learns the two models together, so the deployment model can benefit from the extra information only when it actually helps, instead of inheriting its mistakes. We provide guarantees that describe when joint training improves prediction accuracy and analyze a simple alternating training algorithm for large, high-dimensional models. Experiments on synthetic data and real-world prediction tasks show that our approach avoids these failures and robustly outperforms standard Two-Stage baselines.

Deep learning models, including Convolutional Neural Networks (CNNs) and Vision Transformers (ViTs), have achieved state-of-the-art performance on various computer vision tasks such as object classification, detection, segmentation, generation, and many more. However, these models are data-hungry as they require more training data to learn millions or billions of parameters. Especially for supervised learning tasks, curating a large number of labeled samples for model training is an expensive and time-consuming task. Active Learning (AL) has been used to address this problem for many years. Existing active learning methods aim at choosing the samples for annotation from a pool of unlabeled samples that are either diverse or uncertain. Choosing such samples may hinder the model's performance as we pool based on one dimension, i.e., either diverse or uncertain. In this paper, we propose four novel hybrid sampling methods for pooling both easy and hard samples, which are also diverse. To verify the efficacy of the proposed methods, extensive experiments are conducted using high and low-confidence samples separately. We observe from our experiments that the proposed hybrid sampling method, Least Confident and Diverse (LCD), consistently performs better compared to state-of-the-art methods. It is observed that selecting uncertain and diverse instances helps the model learn more distinct features. The codes related to this study will be available at https://github.com/XXX/LCD.

When annotators disagree, that disagreement can reflect epistemic uncertainty rather than simple label noise. We study hard-label delivery as an alternative to the usual choices of collapsing votes to a single label or training directly on the empirical soft-label distribution. We focus on two primary hard-label methods: multipass, which cycles through observed votes while keeping the dataset size fixed, and stochastic label sampling (SLS), which samples one label per example at the start of each epoch. On CIFAR-10H, we find that when only a small number of annotations per example is available, hard-label delivery improves over soft-label training, with larger improvements where the sparse empirical target is farther from the full annotator distribution. When full annotator distributions are available, both hard-label methods match soft-label training. We use deterministic control as an ablation of multipass and shuffled SLS as a control that breaks the example-to-distribution match. We also show that SLS and soft-label cross-entropy optimize the same expected objective. Hard-label delivery also converges to flatter basins, with supporting descriptive evidence from OOD detection on SVHN and CIFAR-100. Overall, these results suggest that multipass is a strong practical default when raw vote counts are available, while SLS offers a lightweight alternative that remains competitive when only a few votes per example are available and matches soft-label training when full annotator distributions are available.

Learning to generalise from limited data is a fundamental challenge for both artificial and biological systems. A common strategy is to extract reusable structure from abundant unlabelled data, enabling efficient adaptation to new tasks from limited labelled data. This two-stage paradigm is now standard in modern training pipelines, where pretraining is followed by fine-tuning or linear probing. We provide an analytical model of this process: structure extraction is formalized as principal component analysis on unlabelled data, and downstream learning as linear regression on a separate labelled dataset. In the high-dimensional regime, we derive exact expressions for training and generalisation error showcasing their dependence on representation dimensionality, unlabelled and labelled sample sizes, and task alignment. Our results show that pretrained representations strongly influence downstream generalisation, and we characterize the optimal representation size as a function of task parameters: with abundant pretraining data but scarce downstream data, maximally compressed representations are optimal, whereas with limited pretraining data, higher-dimensional representations generalise better. Furthermore, we establish an exact trade-off between pretraining and supervision, quantifying how much unlabelled data is required to replace a single labelled sample. Beyond our idealised model, we observe similar phenomenology in autoencoders and pretrained LLMs. Altogether, we highlight that optimising representation size is critical, giving conditions for when compression during pretraining improves generalisation.

Gradient-based attacks are important methods for evaluating model robustness. However, since the proposal of APGD, it has been difficult for such methods to achieve significant breakthroughs. To achieve such an effect, we first analyze the issue of "high-loss non-adversarial examples" that degrades attack performance in previous methods, and prove that this issue arises from inappropriate objectives for adversarial example generation. Subsequently, we reconstruct the objective as "maximizing the difference between the non-ground-truth label probability upper bound and the ground-truth label probability", and proposes a novel and powerful gradient-based attack method named Sequential Difference Maximization (SDM). SDM establishes a three-layer optimization framework of "cycle-stage-step". It adopts the negative probability loss function and the Directional Probability Difference Ratio (DPDR) loss function in the initial and subsequent optimization stages, respectively, and approaches the ideal objective of adversarial example generation via stage-wise sequential optimization. Experiments demonstrate that compared with previous state-of-the-art methods, SDM not only achieves stronger attack performance but also exhibits superior cost-effectiveness. The code is available at https://github.com/X-L-Liu/ICML-SDM.

Test-time adaptation (TTA) enables a pre-trained model to adapt online to an unlabeled test stream under distribution shift. While most TTA research focuses on the adaptation objective, practical streams also depend critically on the memory used to select which test samples drive adaptation. Existing memory mechanisms are usually evaluated as components of specific TTA algorithms, making it difficult to isolate which memory design choices matter and when they matter. In this work, we provide a systematic benchmark that decouples memory from the adaptation algorithm and evaluates memory policies under unified conditions across i.i.d., non-i.i.d., continual, and practical test streams. Our study shows that effective memory management requires more than retaining recent or class-balanced samples. In particular, intra-class diversity is a key factor for avoiding redundant buffers and maintaining representative adaptation signals under temporally correlated and label-skewed streams. Motivated by this finding, we introduce Guided Observational Test-Time Adaptation (GOTTA), a family of diversity-aware memory policies that combine class-balanced allocation with feature-space diversity. GOTTA memories act as drop-in replacements for existing buffers and can be paired with different TTA objectives. Across corruption benchmarks and video-stream settings, diversity-aware memory improves adaptation most clearly under constrained memory budgets and challenging non-i.i.d. streams, while remaining competitive as memory capacity increases. These results highlight memory management as a first-class component of robust test-time adaptation and identify diversity as a central principle for practical TTA.

In the transductive setting, where the full graph is observed but node labels are only partially available, progress in semi-supervised node classification has largely focused on architectural innovation. In this paper, we revisit an orthogonal axis: the training objective. We start from a simple observation: transductive models produce predictions for every node during training, including nodes without labels. These unlabeled-node predictions may contain useful training signal, but standard supervised objectives discard them because no ground-truth labels are available. Inspired by the decomposition of cross-entropy into a label-dependent alignment term and a label-independent entropy term, we propose prediction confidence as a natural way to extract this signal in the absence of labels. This motivates Transductive Sharpening (TS): a loss-level modification that minimizes prediction entropy on unlabeled nodes while counterbalancing this effect on labeled nodes. We evaluate Transductive Sharpening across a wide range of node-classification benchmarks and observe consistent performance improvements without requiring any changes to the backbone architecture. Code is available at https://github.com/transductive-sharpening/tunedGNN.

Weakly labeled datasets such as AudioSet have driven recent progress in audio tagging. However, annotation quality varies across sound classes. Labels may be incomplete, ambiguous, or unreliable, which introduces class-dependent supervision bias during optimisation. The issue becomes harder as real and generated audio are increasingly mixed in training, and generated samples do not always match their intended semantic labels. Prior work mainly addressed unreliable supervision from missing-positive labels, while this paper targets three other sources of unreliable supervision: spurious additions, misassignments between similar classes, and weakened label evidence. These effects introduce class-dependent optimisation bias that is not explicitly modeled by most existing methods. To bridge this gap, the paper proposes a Class-wise Supervision Unreliability (CSU) framework that controls supervision strength at the class level during training. CSU learns a separate unreliability parameter for each class and down-weights less reliable supervision without changing the model architecture or inference process. To support evaluations, this paper also introduces ESC-FreeGen50, a manually verified benchmark of 50 sound classes that combines real and generated audio. Experiments on controlled benchmarks and AudioSet show that CSU improves robustness across different architectures and different sources of supervision unreliability. The results indicate that explicit class-wise modeling of supervision unreliability is an effective and practical strategy for robust audio tagging under large-scale weakly labeled training. Code and data are available at: https://github.com/Yuanbo2020/CSU

We propose a new method of learning from positive and unlabeled (PU) examples in highly imbalanced datasets. Many real-world problems, such as disease gene identification, targeted marketing, fraud detection, and recommender systems, are hard to address with machine learning methods, due to limited labeled data. Often, training data comprises positive and unlabeled instances, the latter typically being dominated by negative, but including also several positive instances. While PU learning is well-studied, few methods address imbalanced settings or hard-to-detect positive examples that resemble negative ones. Our approach uses a focused empirical risk estimator, incorporating both positive and unlabeled examples to train binary classifiers. Empirical evaluations demonstrate state-of-the-art performance on imbalanced datasets under two labeling mechanisms - selecting positives completely at random (SCAR) and selecting at random (SAR). Beyond these controlled experiments, we demonstrate the value of the proposed method in the real-world application of financial misstatement detection.

Detecting concept drift in high-speed data streams remains challenging, particularly when models must operate on unlabeled data and avoid false alarms caused by benign shifts. While disagreement-based uncertainty has shown promise in neural networks, its adaptation to ensembles of incremental decision trees (IDTs) remains largely unexplored. We investigate this approach by constructing batch-specific disagreement measures via label flipping in ensemble members and evaluating their effectiveness for drift detection in tabular data streams. Our experiments show that, although this method performs well in ensembles of multi-layer perceptrons (MLPs), it consistently underperforms loss-based detectors when applied to IDTs. We attribute this behavior to the intrinsic rigidity of IDTs: learning primarily through structural expansion, with limited parameter adaptation, restricts model plasticity and prevents disagreement from reliably reflecting learning potential. Recent work on restructuring IDTs using their intrinsic decomposition into non-overlapping rules offers a promising direction for improving adaptability.

We study a graph pathfinding problem Distance-$r$ Independent Unlabeled Multi-Agent Pathfinding, finding a set of collision-free paths between two sets where agents must stay at pairwise distance at least $r+1$ at all times. This additional constraint, generalizing collision modeling for classical MAPF, targets aspects of real-world multi-agent coordination. This additional distance constraint makes feasibility (i.e., whether a solution exists) PSPACE-complete, in contrast to standard (unlabeled) MAPF, where it can be decided in polynomial time. We address the challenge via two complementary approaches: (i) reduction-based optimal algorithms with a feasibility-preserving compression procedure, and (ii) a configuration generator-based search. Despite the hardness, empirical results show that our algorithm can handle hundreds of agents in a practical timeframe.

Unsupervised tabular anomaly detection methods typically learn feature patterns from normal samples during training and subsequently identify samples that deviate from these patterns as anomalies during testing. However, in practical scenarios, the limited scale and diversity of training data often lead to an incomplete characterization of normal patterns. While test-time adaptation offers a remedy, its isolated focus on test-time optimization ignores the critical synergy with training-phase learning. Furthermore, indiscriminate adaptation to unlabeled test data inevitably triggers anomaly contamination, preventing the model from fully realizing its discriminative capability between normal and anomalous samples. To address these issues, we propose RTTAD, a Risk-aware Test-time adaptation method for unsupervised Tabular Anomaly Detection. RTTAD holistically tackles normality shifts via a synergistic two-stage mechanism. During training, collaborative dual-task learning captures multi-level representations to establish a robust normal prior. During testing, a Test-Time Contrastive Learning (TTCL) module explicitly accounts for adaptation risk by selectively updating the model using high-confidence pseudo-normal samples while constraining anomalous ones. Additionally, TTCL incorporates a k-nearest neighbor-based contrastive objective to refine embedding distributions, thereby further enhancing the model's discriminative capacity. Extensive experiments on 15 tabular datasets demonstrate that RTTAD achieves state-of-the-art overall detection performance.

Semi-supervised learning faces significant challenges in realistic scenarios where labeled data is scarce and unlabeled data follows unknown, arbitrary distributions. We formalize this critical yet under-explored paradigm as Universal Semi-supervised Learning (UniSSL). Existing methods typically leverage unlabeled data via pseudo-labeling. However, they often rely on the idealized assumption of a uniform unlabeled data distribution or require sufficient labeled data to estimate it. In the UniSSL setting, such dependencies lead to numerous erroneous pseudo-labels, thereby triggering representation confusion. Fortunately, we observe that inter-sample relations captured by representations are more reliable than pseudo-labels. Leveraging this insight, we shift our focus to representation-level structural inference to bypass distribution estimation. Accordingly, we propose Simplex Anchored Graph-state Equipartition (SAGE), which captures high-order inter-sample dependencies to establish structural consensus for guiding representation learning. Meanwhile, to mitigate representation confusion, we employ vectors that satisfy a simplex equiangular tight frame to serve as a coordinate frame for guiding inter-class representation separation. Finally, we introduce a weighting strategy based on distribution-agnostic metrics to prioritize reliable pseudo-labels and an auxiliary branch to isolate potentially erroneous pseudo-labels. Evaluations on five standard benchmarks show that SAGE consistently outperforms state-of-the-art methods, with an average accuracy gain of \textbf{8.52%}.

Cooperative inference across independently deployed machine learning models is increasingly desirable in distributed environments, as there is a growing need to leverage multiple models while keeping their data and model parameters private. However, existing cooperative frameworks typically rely on sharing input data, model parameters, or a common encoder, which limits their applicability in privacy-sensitive or cross-organizational settings. To address this challenge, we propose Consensus Embedding-based Federated Inference (CE-FI), a framework that enables pretrained models to cooperate at inference time without sharing model parameters or raw inputs and without assuming a common encoder. CE-FI introduces two components: a Consensus Embedding (CE) layer that maps heterogeneous intermediate representations into a common embedding space, and a Cooperative Output (CO) layer that produces predictions from these embeddings. Both layers are trained using shared unlabeled data only, so the cooperative stage does not require additional labeled data. Experiments on image classification benchmarks -- CIFAR-10 and CIFAR-100 -- under diverse non-IID conditions show that CE-FI consistently outperforms solo inference and performs comparably to conventional methods that require stronger sharing assumptions. Additional evaluations on text and time-series tasks indicate applicability beyond image classification, although performance depends on the ensemble strategy. Further analysis identifies representation alignment as the primary bottleneck.

Simulation-based inference (SBI) provides amortized Bayesian parameter inference from simulator-generated data without requiring explicit likelihood evaluation. Its reliability can degrade under model misspecification, where real-world observations are not well represented by the simulator used for training. Existing methods using unlabeled real-world data often align simulated and real-world data distributions, but marginal alignment alone does not directly preserve parameter-relevant information needed for posterior inference. We propose SPIN, an SBI framework with parameter-relevant information-preserving domain transfer using unlabeled, unpaired real-world observations. During training, SPIN translates labeled simulator observations toward the real-world domain and back to the simulator domain, using the original simulator labels to encourage domain transfer that preserves parameter-relevant mutual information. At test time, the learned real-to-simulator transport maps real-world observations into the simulator domain for posterior inference, without requiring real-world parameter labels or paired real--simulator observations. Across controlled synthetic and physical real-world benchmarks, SPIN improves real-world posterior inference, with the improvement becoming clearer as misspecification increases.

Positive-unlabeled (PU) learning addresses binary classification when only a set of labeled positives is available alongside a pool of unlabeled samples drawn from a mixture of positives and negatives. Existing PU methods typically require dataset-specific training or iterative optimization, which limits their applicability when many tasks must be solved quickly or with little tuning. We introduce PUICL, a pretrained transformer that solves PU classification entirely through in-context learning. PUICL is pretrained on synthetic PU datasets generated from randomly instantiated structural causal models, exposing it to a wide range of feature-label relationships and class-prior configurations. At inference time, PUICL receives the labeled positives and the unlabeled samples as a single input and returns class probabilities for the unlabeled rows in one forward pass, with no gradient updates or per-task fitting. On 20 semi-synthetic PU benchmarks derived from the UCI Machine Learning Repository, OpenML, and scikit-learn, PUICL outperforms four standard PU learning baselines in average AUC and accuracy, and is competitive on F1-score. These results show that the in-context learning paradigm extends naturally beyond fully supervised tabular prediction to the semi-supervised PU setting.

Domain adaptation aims to transfer knowledge from a labeled source domain to an unlabeled target domain with different distributions. In real-world scenarios, the label spaces of the two domains often have an inclusion relationship, where some classes exist only in one domain but not the other. These non-overlapping classes are referred to as private classes. Identifying private class samples and mitigating their adverse effects is critical in the literature. Existing methods rely on the assumption that shifts in private classes are large enough to be considered outliers. However, the variance within a single shared class can be significantly larger than the difference between a private class and another shared class, challenging this assumption. Consequently, private classes substantially increase the difficulty of cross-domain classification. To address these issues, based on local transportation and metric properties of optimal transport (OT), a locality-aware private class identification approach is proposed in the form of a score function on transport mass. The effectiveness of the proposed approach is theoretically proven, highlighting the score function's strong ability to distinguish between shared and private class samples. Building on this, we introduce a reliable OT-based method (ReOT) for domain adaptation under severe label shift. ReOT minimizes classification risk while learning the separated cluster structure between the identified shared classes and private classes, effectively avoiding mismatch between shared-private sample pairs, thus ensuring that important knowledge is reliably transported intra-class to mitigate class-conditional discrepancy. Furthermore, a generalization upper bound of the target risk is provided for extreme label shift scenarios, which can be minimized by ReOT. Extensive experiments on benchmarks validate the effectiveness of ReOT.

Label Distribution Learning (LDL) models supervision as an instance-wise probability distribution, enabling fine-grained learning under inherent ambiguity, but its success relies on high-fidelity label distributions that are costly to obtain and thus often noisy. Motivated by privacy-sensitive applications, we study Federated Label Distribution Learning (Fed-LDL), where data isolation further induces heterogeneous annotation quality across clients, making local updates unevenly reliable and breaking sample-size-based aggregation (e.g., FedAvg). To address this trust dilemma, we propose FedQual, a quality-aware Fed-LDL framework with two coupled mechanisms: (i) quality-adaptive client training guided by a global semantic anchor that calibrates low-quality clients while preserving high-quality autonomy, and (ii) reliability-aware server aggregation that reweights client contributions by effective reliable information rather than raw sample size. To enable rigorous evaluation, we construct four new Fed-LDL benchmarks (FER-LDL, FI-LDL, PIPAL-LDL, and KADID-LDL) with controlled annotation quality disparity. We further provide a theoretical guarantee showing that under heterogeneous supervision quality, client-specific calibration is strictly better than any uniform calibration. Extensive experiments on the proposed benchmarks demonstrate the effectiveness of FedQual.

Out-of-distribution (OOD) detection identifies test samples that fall outside a model's training distribution, a capability critical for safe deployment in high-stakes applications. Standard OOD detectors are trained on a specific in-distribution (ID) dataset and detect deviations from that single domain. In contrast, we study few-shot cross-domain OOD detection: given a \emph{single} pre-trained model, can we perform OOD detection on \emph{arbitrary} new ID-OOD task pairs using only a handful of ID samples at inference time, with no additional training? We propose \textbf{UFCOD}, a unified framework that achieves this goal through information-geometric analysis of diffusion trajectories. Our key insight is that diffusion noise predictions are score functions (gradients of log-density), and we extract two energy features: \emph{Path Energy} (integrated score magnitude) and \emph{Dynamics Energy} (score smoothness), that form a discrete Sobolev norm capturing how samples interact with the learned diffusion process. The central contribution is a \textbf{train-once, deploy-anywhere} paradigm: a diffusion model trained on a single dataset (e.g., CelebA) serves as a universal feature extractor for OOD detection across semantically unrelated domains (e.g., CIFAR-10, SVHN, Textures). At deployment, each new task requires only $\sim$100 unlabeled ID samples for inference: no retraining, no fine-tuning, no task-specific adaptation. Using 100 ID samples per task, UFCOD achieves 93.7% average AUROC across 12 cross-domain benchmarks, competitive with methods trained on 50k--163k samples, demonstrating $\sim$500$\times$ improvement in sample efficiency. See our code in https://github.com/lili0415/UFCOD.

We consider selective classification with abstention in the fixed-pool (or transductive) setting, where the unlabeled pool is given beforehand and only a subset of points can be queried for labels. Our main insight is to view selective prediction through agreement: given queried labels and Lipschitz margin constraints in an embedding space, the version space of Lipschitz-consistent classification heads is well defined. We obtain upper and lower Lipschitz margin bounds that define, for each pool point, a set of certified valid labels containing the prediction of every head in the version space. The model therefore predicts only when the label is forced (i.e., all consistent heads agree), and abstains otherwise. We also propose a monotone submodular geometric proxy for budgeted querying, and show that a greedy algorithm retains the standard approximation factor.

Graph self-supervised learning typically relies on large-scale unlabeled datasets, heavily inflating computational costs. However, empirical evidence suggests that these datasets contain substantial redundancy-our analysis reveals that uniformly subsampling 50% of graphs retains over 96% of downstream performance. To exploit this redundancy, we introduce GraphSculptor for pre-training coreset construction. Unlike methods dependent on additional training-time signals or limited solely to topological statistics, GraphSculptor provides a label-free solution that constructs coresets via two complementary perspectives: intrinsic structure and contextual semantics. Concretely, structural diversity is quantified using intrinsic graph statistics, yielding a structural feature vector for each graph, while semantic diversity is captured by utilizing a pre-trained language model to encode descriptions generated via graph-to-text. GraphSculptor integrates these signals into a unified metric space and performs cluster-aware selection to preserve joint structural-semantic diversity. We further derive a theoretical bound on the loss gap between coreset and full-data pre-training, offering theoretical motivation for our selection formulation. Extensive experiments demonstrate that GraphSculptor effectively sculpts the dataset: a 10% coreset achieves 99.6% of full-data performance while reducing pre-training time by nearly 90%, offering a scalable solution for data-efficient graph pre-training.

Face recognition from a single image per person is a challenging problem because the training sample is extremely small. We consider a variation of this problem. In our problem, we recognize only one person, and there are no labeled data for any other person. This setting naturally arises in authentication on personal computers and mobile devices, and poses additional challenges because it lacks negative examples. We formalize our problem as one-class classification, and propose and analyze an algorithm that learns a non-parametric model of the face from a single labeled image and a stream of unlabeled data. In many domains, for instance when a person interacts with a computer with a camera, unlabeled data are abundant and easy to utilize. This is the first paper that investigates how these data can help in learning better models in the single-image-per-person setting. Our method is evaluated on a dataset of 43 people and we show that these people can be recognized 90% of time at nearly zero false positives. This recall is 25+% higher than the recall of our best performing baseline. Finally, we conduct a comprehensive sensitivity analysis of our algorithm and provide a guideline for setting its parameters in practice.

A central problem in unsupervised domain adaptation is determining what to transfer from labeled source domains to an unlabeled target domain. To handle high-dimensional observations (e.g., images), a line of approaches use deep learning to learn latent representations of the observations, which facilitate knowledge transfer in the latent space. However, existing approaches often rely on restrictive assumptions to establish identifiability of the joint distribution in the target domain, such as independent latent variables or invariant label distributions, limiting their real-world applicability. In this work, we propose a general domain adaptation framework that learns compact latent representations to capture distribution shifts relative to the prediction task and address the fundamental question of what representations should be learned and transferred. Notably, we first demonstrate that learning representations based on all the predictive information, i.e., the label's Markov blanket in terms of the learned representations, is often underspecified in general settings. Instead, we show that, interestingly, general domain adaptation can be achieved by partitioning the representations of Markov blanket into those of the label's parents, children, and spouses. Moreover, its identifiability guarantee can be established. Building on these theoretical insights, we develop a practical, nonparametric approach for domain adaptation in a general setting, which can handle different types of distribution shifts.

Semi-supervised classification, where unlabeled data are massive but labeled data are limited, often arises in machine learning applications. We address this challenge under high-dimensional data by leveraging the manifold and cluster assumptions. Based on the Fermat distance, a density-sensitive metric that naturally encodes the cluster assumption, we propose the weighted $k$-nearest neighbors (NN) classifier and multidimensional scaling (MDS)-induced classifiers. The use of MDS with a large target dimension allows the effective application of linear classifiers to complex manifold data. Theoretically, we derive a sharp lower bound for the expected excess risk within clusters and prove that the weighted $k$-NN classifier utilizing the true Fermat distance is minimax optimal. Furthermore, we explicitly quantify the utility of unlabeled data by showing that the error arising from estimating the Fermat distance decays exponentially with the pooled sample size. Such a rate is much faster than the related rates in the literature. Extensive experiments on synthetic and real datasets demonstrate competitive or superior performance of our approaches compared to state-of-the-art graph-based semi-supervised classifiers.

Active learning algorithms automatically identify the most informative samples from large amounts of unlabeled data and tremendously reduce human annotation effort in inducing a machine learning model. In a conventional active learning setup, the labeling oracles are assumed to be infallible, that is, they always provide correct answers (in terms of class labels) to the queried unlabeled instances, which cannot be guaranteed in real-world applications. To this end, a body of research has focused on the development of active learning algorithms in the presence of imperfect / noisy oracles. Existing research on active learning with noisy oracles typically simulate the oracles using machine learning models; however, real-world situations are much more challenging, and using ML models to simulate the annotation patterns may not appropriately capture the nuances of real-world annotation challenges. In this research, we first collect annotations of text samples (from 3 benchmark text classification datasets) from crowd-sourced workers through a crowd-sourcing platform. We then conduct extensive empirical studies of 8 commonly used active learning techniques (in conjunction with deep neural networks) using the obtained annotations. Our analyses sheds light on the performance of these techniques under real-world challenges, where annotators can provide incorrect labels, and can also refuse to provide labels. We hope this research will provide valuable insights that will be useful for the deployment of deep active learning systems in real-world applications. The obtained annotations can be accessed at https://github.com/varuntotakura/al_rcta/.

Open-vocabulary scene graph generation (SGG) aims to describe visual scenes with flexible relation phrases beyond a fixed predicate set. Existing methods usually treat annotated triplets as positives and all unannotated object-pair relations as negatives. However, scene graph annotations are inherently incomplete: many valid relations are missing, and the same interaction can be described at different granularities, e.g., \textit{on}, \textit{standing on}, \textit{resting on}, and \textit{supported by}. This issue becomes more severe in open-vocabulary SGG due to the much larger relation space. We propose \textbf{ReLIC-SGG}, a relation-incompleteness-aware framework that treats unannotated relations as latent variables rather than definite negatives. ReLIC-SGG builds a semantic relation lattice to model similarity, entailment, and contradiction among open-vocabulary predicates, and uses it to infer missing positive relations from visual-language compatibility, graph context, and semantic consistency. A positive-unlabeled graph learning objective further reduces false-negative supervision, while lattice-guided decoding produces compact and semantically consistent scene graphs. Experiments on conventional, open-vocabulary, and panoptic SGG benchmarks show that ReLIC-SGG improves rare and unseen predicate recognition and better recovers missing relations.

Active learning (AL) has emerged as a crucial methodology for minimizing labeling costs in deep learning by selecting the most valuable samples from a pool of unlabeled data for annotation. Traditional AL operates under a closed-set assumption, where all classes in the dataset are known and consistent. However, real-world scenarios often present open-set conditions in which unlabeled data contains both known and unknown classes. In such environments, standard AL techniques struggle. They can mistakenly query samples from unknown categories, leading to inefficient use of annotation budgets. In this paper, we propose a novel dual-stage energy-based framework for open-set AL. Our method employs two specialized energy-based models (EBMs). The first, an energy-based known/unknown separator, filters out samples likely to belong to unknown classes. The second, an energy-based sample scorer, assesses the informativeness of the filtered known samples. Using the energy landscape, our models distinguish between data points from known and unknown classes in the unlabeled pool by assigning lower energy to known samples and higher energy to unknown samples, ensuring that only samples from classes of interest are selected for labeling. By integrating these components, our approach ensures efficient and targeted sample selection, maximizing learning impact in each iteration. Experiments on 2D (CIFAR-10, CIFAR-100, TinyImageNet) and 3D (ModelNet40) object classification benchmarks demonstrates that our framework outperforms existing approaches, achieving superior annotation efficiency and classification performance in open-set environments.

Large-scale dataset distillation requires storing auxiliary soft labels that can be 30-40x larger on ImageNet-1K and 200x larger on ImageNet-21K than the condensed images, undermining the goal of dataset compression. We identify two fundamental issues necessitating such extensive labels: (1) insufficient image diversity, where high within-class similarity in synthetic images requires extensive augmentation, and (2) insufficient supervision diversity, where limited variety in supervisory signals during training leads to performance degradation at high compression rates. To address these challenges, we propose Label Pruning and Quantization for Large-scale Distillation (LPQLD). We enhance image diversity via class-wise batching and batch-normalization supervision during synthesis. For supervision diversity, we introduce Label Pruning with Dynamic Knowledge Reuse to improve label-per-augmentation diversity, and Label Quantization with Calibrated Student-Teacher Alignment to improve augmentation-per-image diversity. Our approach reduces soft label storage by 78x on ImageNet-1K and 500x on ImageNet-21K while improving accuracy by up to 7.2% and 2.8%, respectively. Extensive experiments validate the superiority of LPQLD across different network architectures and dataset distillation methods. Code is available at https://github.com/he-y/soft-label-pruning-quantization-for-dataset-distillation.

Learning from preference-based feedback has become an effective approach for aligning LLMs across diverse tasks. However, high-quality human-annotated preference data remains expensive and scarce. Existing methods address this challenge through either self-rewarding, which scales by using purely AI-generated labels but risks unreliability, or active learning, which ensures quality through oracle annotation but cannot fully leverage unlabeled data. In this paper, we present CoAct, a novel framework that synergistically combines self-rewarding and active learning through strategic human-AI collaboration. CoAct leverages self-consistency to identify both reliable self-labeled data and samples that require oracle verification. Additionally, oracle feedback guides the model to generate new instructions within its solvable capability. Evaluated on three reasoning benchmarks across two model families, CoAct achieves average improvements of +13.25% on GSM8K, +8.19% on MATH, and +13.16% on WebInstruct, consistently outperforming all baselines.

The present study aims to investigate a cluster cleaning algorithm that is both computationally simple and capable of solving the PU classification when the SCAR condition is unsatisfied. A secondary objective of this study is to determine the robustness of the LassoJoint method to perturbations of the SCAR condition. In the first step of our algorithm, we obtain cleaning labels from 2-means clustering. Subsequently, we perform logistic regression on the cleaned data, assigning positive labels from the cleaning algorithm with additional true positive observations. The remaining observations are assigned the negative label. The proposed algorithm is evaluated by comparing 11 real data sets from machine learning repositories and a synthetic set. The findings obtained from this study demonstrate the efficacy of the clustering algorithm in scenarios where the SCAR condition is violated and further underscore the moderate robustness of the LassoJoint algorithm in this context.

The unauthorized use of personal data in model training has emerged as a growing privacy threat. Unlearnable examples (UEs) address this issue by embedding imperceptible perturbations into benign examples to obstruct feature learning. However, existing studies mainly evaluate UEs under from-scratch training settings, leaving their behavior under the widely adopted pretraining-finetuning (PF) paradigm largely unexplored. In this work, we provide the first systematic investigation of unlearnable examples across diverse training paradigms. Our analysis reveals that loading and freezing pretrained weights significantly weakens the effectiveness of existing UEs methods. We further explain these findings through semantic filtering: while UEs tend to induce models to overfit non-semantic noise, thereby weakening their semantic extraction capabilities, under the PF paradigm, frozen shallow layers preserve data semantics, effectively filtering out distracting information like unlearnable noise. Guided by these insights, we propose a hierarchical deception strategy, Shallow Semantic Camouflage (SSC), that confines the generation process to a semantically valid subspace, aiming to bypass the semantic suppression introduced by pretrained weights. Extensive experiments demonstrate that our method consistently preserves data unlearnability even under challenging training paradigms, such as shallow-layer freezing and semantic-focused pretraining (SF-Pretrain), bridging the critical gap in pretrain-based unlearnable learning.

In NLP classification tasks where little labeled data exists, domain fine-tuning of transformer models on unlabeled data is an established approach. In this paper we have two aims. (1) We describe our observations from fine-tuning the Finnish BERT model on Finnish medical text data. (2) We report on our attempts to predict the benefit of domain-specific pre-training of Finnish BERT from observing the geometry of embedding changes due to domain fine-tuning. Our driving motivation is the common\situation in healthcare AI where we might experience long delays in acquiring datasets, especially with respect to labels.

Prompt learning has gained significant attention as a parameter-efficient approach for adapting large pre-trained vision-language models to downstream tasks. However, when only partial labels are available, its performance is often limited by label ambiguity and insufficient supervisory information. To address this issue, we propose Holistic Optimal Label Selection (HopS), leveraging the generalization ability of pre-trained feature encoders through two complementary strategies. First, we design a local density-based filter that selects the top frequent labels from the nearest neighbors' candidate sets and uses the softmax scores to identify the most plausible label, capturing structural regularities in the feature space. Second, we introduce a global selection objective based on optimal transport that maps the uniform sampling distribution to the candidate label distributions across a batch. By minimizing the expected transport cost, it can determine the most likely label assignments. These two strategies work together to provide robust label selection from both local and global perspectives. Extensive experiments on eight benchmark datasets show that HopS consistently improves performance under partial supervision and outperforms all baselines. Those results highlight the merit of holistic label selection and offer a practical solution for prompt learning in weakly supervised settings.

Factorizable joint shift (FJS) represents a type of distribution shift (or dataset shift) that comprises both covariate and label shift. Recently, it has been observed that FJS actually arises from consecutive label and covariate (or vice versa) shifts. Research into FJS so far has been confined mostly to the case of categorical labels. We propose a framework for analysing distribution shift in the case of a general label space, thus covering both classification and regression models. Based on the framework, we generalise existing results on FJS to general label spaces and present and analyse a related extension to label distribution estimation of the expectation maximisation (EM) algorithm for class prior probabilities. We also take a fresh look at generalized label shift (GLS) in the case of a general label space.

Semi-supervised few-shot learning (SSFSL) resembles real-world applications such as auto-annotation, as it aims to learn a model from a few labeled and abundant unlabeled task-specific examples to annotate the unlabeled ones. Despite the availability of powerful open-source Vision-Language Models (VLMs) and open-world data, existing SSFSL literature largely neglects these resources. In contrast, the related area few-shot learning (FSL) has already exploited them to boost performance. Arguably, to solve real-world auto-annotation, SSFSL should leverage such open resources. To bridge this gap, we explore established SSL methods to finetune a VLM. Unexpectedly, they significantly underperform FSL baselines that do not use unlabeled data. Our in-depth analysis reveals the root cause of failure: VLMs produce flat distributions of softmax probabilities, resulting in zero utilization of unlabeled data and weak supervision signals. To address this challenge, we propose an embarrassingly simple solution that uses temperatures to sharpen the softmax output, which not only increases the confidence scores of pseudo-labels to improve the utilization of unlabeled data, but also strengthens training supervision for effective finetuning. Furthermore, we exploit task-relevant open data, e.g., those retrieved from VLMs' publicly available pretraining set. To mitigate the imbalance and domain gaps in retrieved data, we employ a stage-wise training strategy. Building on the successful finetuning of VLMs and the exploitation of open data, we present a simple yet effective SSFSL method, Stage-Wise Finetuning with Temperatures (SWIFT). Across five benchmarks, SWIFT outperforms recent FSL and SSL methods by $\sim$5 accuracy points. SWIFT even rivals supervised learning, which finetunes a VLM assuming unlabeled data having ground-truth labels!

Predicting which hypothetical inorganic crystals can be experimentally realized remains a central challenge in accelerating materials discovery. SyntheFormer is a positive-unlabeled framework that learns synthesizability directly from crystal structure, combining Fourier-transformed crystal properties (FTCP) representation with structure-aware feature extraction, Random-Forest feature selection, and a compact deep MLP classifier. The model is trained on historical data from 2011 through 2018 and evaluated prospectively on future years from 2019 to 2025, where the positive class constitutes only 1.02 percent of samples. Under this temporally separated evaluation, SyntheFormer achieves a test AUC of 0.735, AUPRC of 0.099 and 97.6 percent recall at 94.2 percent coverage with dual-threshold calibration. Direct prospective validation supports this result as two materials that were unlabeled at the time of data curation, Y6Fe(SiS7)2 and BaYb2F8, were assigned high SyntheFormer scores (0.961 and 0.753, respectively) and were subsequently reported experimentally. Crucially, the model recovers experimentally confirmed metastable compounds that lie far from the convex hull and simultaneously assigns low scores to many thermodynamically stable yet unsynthesized candidates, demonstrating that stability alone is insufficient to predict experimental attainability.

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.

Multi-view learning is widely applied to real-life datasets, but it often suffers from both missing views and missing labels. Prior probabilistic approaches addressed the missing view problem by using a product-of-experts scheme to aggregate representations from present views and achieved superior performance over deterministic classifiers, using the information bottleneck (IB) principle. However, the IB framework is inherently fully supervised and cannot leverage unlabeled data. In this work, we propose a semi-supervised generative model that utilizes both labeled and unlabeled samples in a unified framework. Our method maximizes the likelihood of unlabeled samples to learn a latent space shared with the IB on labeled data. We also include modality-specific information in likelihood modeling and perform cross-view mutual information maximization in the shared latent space to enhance the extraction of shared information across views. Compared to existing approaches, our model achieves better predictive and generation performance on complex datasets with missing views and limited labeled samples.

Federated Graph Learning (FGL) is a distributed learning paradigm that enables collaborative training over large-scale subgraphs located on multiple local systems. However, most existing FGL approaches rely on synchronous communication, which leads to inefficiencies and is often impractical in real-world deployments. Meanwhile, current asynchronous federated learning (AFL) methods are primarily designed for conventional tasks such as image classification and natural language processing, consequently failing to account for the unique topological properties of graph data. Directly applying these methods to graph learning frequently results in semantic drift and representational inconsistency within the global model. To address these challenges, we propose FedSA-GCL, a semi-asynchronous federated framework that leverages both inter-client label distribution divergence and graph topological characteristics through a novel ClusterCast mechanism for efficient training. We evaluate FedSA-GCL on multiple real-world graph datasets using the Louvain and Metis algorithms and conduct comparative analysis against 10 baselines. Extensive experiments demonstrate that our method achieves superior robustness and outstanding efficiency, outperforming the baselines by an average margin of 1.9% with Louvain and 3.0% with Metis.

Machine learning systems deployed in distributed or federated environments are highly susceptible to adversarial manipulations, particularly availability attacks -- rendering the trained model unavailable. Prior research in distributed ML has demonstrated such adversarial effects through the injection of gradients or data poisoning. In this work, we ask whether comparable degradation is still possible under a substantially more constrained action space: the adversary may only flip a limited number of labels of existing training examples, without modifying features, injecting samples, or directly controlling gradients. We analyze the extent of damage caused by constrained label flipping attacks against distributed learning under mean aggregation -- the dominant baseline in research and production. Focusing on classification problems, (1) we propose a novel formalization of label flipping attacks as a per-round constrained optimization problem, derive a greedy label-selection rule for logistic regression, and empirically evaluate it beyond its derivation setting, including on MLPs and robust aggregators. The rule is provably per-epoch optimal for the attacker under the mean aggregator. (2) Empirically, we show that optimized label flipping can cause substantial accuracy degradation while outperforming random label flipping under similar budgets. (3) We shed light on an interesting interplay between what the attacker gains from more write-access versus what they gain from more flipping budget. (4) Finally, although the attack is derived for mean aggregation, we find that it can transfer empirically to the coordinate-wise median and trimmed mean aggregators, where its effectiveness approaches that of the Little-is-Enough gradient attack. This demonstrates that even highly constrained label-flipping adversaries can pose a significant availability threat to distributed learning.

This paper explores the use of linear aggregation to protect the privacy of sensitive training labels through the concept of \emph{label differential privacy} (label-DP) while maintaining regression task utility. Our key finding is that weighted linear aggregation of training instances with i.i.d. $N(0, 1)$ weights can achieve $(\varepsilon, \delta)$-label-DP with $m = O\left(n/(\log(1/\delta))\right)$. Unlike prior methods, our approach relies on the minimum linear regression loss rather than the minimum singular value of the data matrix, resulting in better practical bounds on real datasets. We also examine real-world mechanisms involving disjoint sets or \textit{bags} of instances. We demonstrate that aggregating labels from sub-sampled disjoint $k$-sized bags using i.i.d. $N(0,1)$ weights achieves $(\varepsilon,\delta)$-label-DP with $k \geq \Omega\left(\left((1/\varepsilon)\log\left(1/\delta\right)\right)^2\right)$. In both scenarios, the optimal linear mse-regressor on the aggregated data approximates the original dataset's optimum with high probability, without needing additive label noise. Furthermore, we show that adding $N(0,1)$ noise to any constant fraction of labels allows for similar label-DP guarantees when aggregating labels over random disjoint bags, while preserving the utility of Lipschitz-bounded neural mse-regression tasks.