Overview

Active learning studies how to choose data or queries so models can learn effectively with fewer labels, measurements, or experiments. Common approaches include uncertainty sampling, diversity and coreset selection, Bayesian information gain, batch strategies, and cost-aware or human-in-the-loop querying; scientific applications also use Gaussian processes, multi-fidelity models, and physics-based acquisition to guide simulations and laboratory work. Work spans image and language benchmarks, medical annotation, robotics, and scientific discovery, with newer methods using foundation-model representations and adapting selection to class imbalance, domain shift, or label noise. A central open tension is that no acquisition strategy wins everywhere: gains depend on the task, budget, model and data, and random sampling can match or outperform sophisticated methods, making realistic evaluations and strong baselines essential.

Latest papers

296 papers39 papers in the last four weeks, up 22% on the four weeks before. 0.2% of all new papers.

Jun 6, 2026

CAAL: Contextual Bandits based Online Hand-Craft Active Learning Strategy Selection

The challenge with active learning algorithms is the uncertainty of the statistical distribution of unlabeled data, making it difficult to choose the best hand-crafted strategy. To address this, we introduced Contextual Adaptive Active Learning (CAAL). In CAAL, each "arm" represents a hand-crafted strategy. Unlike existing frameworks that select strategies based only on feedback from labeled data, we dynamically choose strategies for labeling batches of data using reward prediction with external context information. This general framework allows for customization with domain knowledge to design more effective rewards and context candidates. In addition, we experimentally show that CAAL outperforms the existing baseline adaptive strategy on public datasets using our reward and context design. Our results are consistent regardless of batch size in each iteration.
Jun 5, 2026

HARP: Efficient Data Selection for Finetuning Large Language Models

Finetuning data selection requires balancing two competing goals: selecting examples that improve the downstream objective, and doing so without repeatedly finetuning models. Train-free selectors are scalable but rely on proxies such as embedding similarity or clustering, which may not match the target objective. Train-based selectors better reflect downstream utility through gradient signals, subset evaluation, or Shapley attribution, but require many costly train-evaluate iterations. We propose Hierarchical Active Region Pruning (HARP), an efficient train-based selector that preserves downstream alignment while reducing selection cost. HARP organizes the training pool into a node-leaf hierarchy, evaluates only representative leaves, and infers unmeasured utilities with empirical Bayes posteriors. It then selects data using two complementary envelopes: HARP-C, which conservatively controls redundancy, and HARP-E, which additively rewards complementary regions. We theoretically show that, under local smoothness and bounded estimation error, HARP controls selection error while reducing train-evaluate cost. Across 3 base models, 3 finetuning datasets, and 4 reasoning benchmarks (36 settings), HARP variants achieve the highest accuracy among ranked methods in 23 settings and obtain 36-setting mean accuracies of 64.2 and 63.5, respectively, compared with 59.3 for the strongest baseline, NICE. HARP-C trains on roughly 9x fewer examples than the budgeted baselines and 75x fewer than full finetuning, combining higher mean accuracy with a smaller mean training-set size than every ranked baseline.
Jun 3, 2026

Activation-Based Active Learning for In-Context Learning: Challenges and Insights

Deep active learning has previously been explored for LLM in-context sample selection, but not with methods that utilise recent advances in understanding of transformer activations. In this paper, we test the hypothesis that model activations could provide a fine-grained signal to optimise the selection of in-context examples. We present a comprehensive analysis of MLP activation-based deep active learning methods applied to in-context learning, including how different attention masking strategies impact active learning across diverse classification and generative datasets, using both Llama-3.2-3B and Qwen2.5-3B base models. However, we find a negative result: MLP and embedding layer outputs, viewed through the lenses of massive activations or the first four moments, do not correlate with example quality or task performance. Specifically, the absolute Spearman correlation coefficient is at most 0.33 for all tasks and models we tested, showing that such activation-based sampling should not be used for in-context learning. We hypothesise that this may be due to superposition, whereby models represent more features than they have dimensionality, suggesting that methods like Sparse Autoencoders (SAEs) may be a promising future direction.
Jun 3, 2026

ALINC: Active Learning for Inductive Node Classification via Graph Sampling

Active learning (AL) for node classification typically focuses on selecting the most informative nodes for annotation within one or a few large graphs (e.g., in social network analysis). However, in other domains, such as molecular chemistry or electronic design automation, datasets consist of thousands of independent graphs. In many of these inductive settings, annotating an individual node requires a full-graph analysis, which effectively yields the remaining node labels on-the-fly. Therefore, these scenarios require AL strategies that select entire graphs instead of single nodes, a problem which has not been tackled in the literature so far. Thus, we introduce ALINC, an AL framework for inductive node classification via graph sampling. It bridges the existing methodological gap by elevating node-level utility measures to graph-level selection criteria through various aggregation mechanisms. In an extensive benchmark including ten strategies, three aggregation methods, and four datasets, we identify CoreSet, TypiClust, and BADGE as the top-performing graph sampling strategies. Our detailed analysis further reveals that the choice of the aggregation method is pivotal, as it substantially affects model performance and annotation costs. Finally, we demonstrate the effectiveness of ALINC in two use case studies: site-of-metabolism prediction in molecules and design automation of printed circuit board schematics.
Jun 3, 2026

Smart Picks in the Dark: Towards Efficient RLVR for Reasoning via Tracing Metacognitive Pivots

Reinforcement learning with verifiable rewards (RLVR) has greatly advanced large reasoning models (LRMs), but it requires timely training on a huge fully-annotated dataset. To this end, data-efficient RLVR methods have been widely studied from two perspectives: (i) data selection methods identify a small subset of "golden" samples that yield near-full-data performance, but they rely on a pre-existing pool of labeled data. (ii) unsupervised RLVR methods train the model using its own internal supervision signals on large-scale unlabeled data, yet they exhibit suboptimal performance. Accordingly, we investigate the "pick in the dark" setup for RLVR, which aims to select, without prior supervision, unlabeled samples that are most beneficial for training and worthy of annotation. Through systematic analysis, we demonstrate that smart picks hinge on a well-calibrated uncertainty estimator to enable strategic partitioning of data for adaptive training regimes. Building on this insight, we propose PivotTrace, a three-way data triage framework that leverages attention dynamics to trace metacognitive pivots during reasoning. By precisely quantifying uncertainty through pivot density, PivotTrace achieves automated data routing to synergistically maximize both annotation and training efficiency. Empirically, PivotTrace surpasses the fully supervised LRM with only 29.3% annotated samples and 2.75 faster convergence.
Jun 2, 2026

Stein Kernelized Molecular Dynamics for Active Learning of Interatomic Potentials

Machine learning interatomic potentials (MLIPs) enable efficient and accurate atomistic simulations but depend critically on the quality and diversity of the training data. We introduce Stein kernelized molecular dynamics (SKMD), an enhanced sampling method that uses interacting particle dynamics to acquire informative training configurations for the active learning and fine-tuning of MLIPs. SKMD corresponds to a stochastic variant of Stein variational gradient descent that is adapted for molecular dynamics by incorporating asynchronous particle updates and a kernel of global atomic descriptors, which provides a symmetry-aware measure of configurational similarity. Unlike other enhanced samplers used in molecular dynamics, SKMD preserves the Boltzmann distribution as the asymptotic distribution of the dynamics. This property enforces a balance between the exploration of diverse configurations and attraction toward high-probability regions of the energy landscape. We further propose an approach to efficient online data acquisition using an adaptive stopping criterion that selects non-redundant training data over the course of simulation. We demonstrate SKMD for the active learning of a neural network model of the Müller-Brown potential and the fine-tuning of a MACE interatomic potential for alanine dipeptide. Compared to active learning baselines, our method achieves higher model accuracy in fewer training iterations with the same number of acquired training samples.
Jun 2, 2026

Finding Needles in the Haystack: Transductive Active Labeling in Ecology

Active learning is now standard practice in labeling ecological data, enabling ecologists to quickly process large volumes of field data to understand and monitor natural environments. Current practices evaluate active learning inductively, estimating predictive performance on a held-out test set. We argue that this evaluation is misaligned with most ecological tasks, where the goal is to transductively label an entire pool of data as efficiently as possible. We demonstrate that ignoring the human-in-the-loop underestimates the importance of continuing to label, particularly for classes in the long tail which may be of disproportionate ecological importance (rare species, uncommon behaviors, etc.). Our analysis shows that, for this long tail, the transductive objective shifts importance from prediction to discovery: the true challenge becomes finding "needles in the haystack," examples of rare classes that are embedded within dense regions of abundant classes in the latent geometry, which we quantify with a novel metric of sampling difficulty. Finally, to translate these insights to practical ecological workflows, we propose a conservative hybrid stopping criterion inspired by ecological rarefaction curves, and show that combining predictive performance with discovery criteria reduces premature stopping on long-tailed pools, improving rare-class recovery when discovery, not classification, is the limiting factor.
Jun 1, 2026

FACT: A Simple and Efficient Framework for Active Finetuning

The main goal of active finetuning is to improve a pretrained model's performance on a specific task or domain by finetuning it with carefully selected informative or challenging data. Previous research has predominantly focused on the active aspect (i.e., data selection) while uniformly employing full finetuning for model adaptation, which inevitably distorts pretrained features due to distribution shift. This issue becomes particularly pronounced when the model size is large relative to the finetuning data quantity, leading to heightened overfitting risks. To address this critical gap, we formally outline the FiAF task that emphasizes systematic exploration of finetuning methodologies in active learning. We propose FACT, a three-phase hierarchical finetuning framework featuring both efficiency and simplicity, specifically designed for active finetuning scenarios. Our comprehensive experiments span: (1) Three major dataset categories encompassing classic (CIFAR10, CIFAR100, ImageNet-1k), imbalanced (CIFAR10-LT, CIFAR100-LT), and fine-grained (StanfordCars, FGVCAircraft) image classification datasets, each evaluated under 3-5 distinct sampling ratios; (2) Diverse pretrained architectures including Convolutional Neural Network (ConvNeXt), Vision Transformer (ViT), and Vision LSTM (ViL) networks; (3) A systematic investigation of frozen feature augmentation (FroFA) strategies. (4) A comprehensive and rigorous analysis of efficiency and generalizability. The results demonstrate significant improvements with strong generalization and robustness. Notably, under low sampling ratios, our framework achieves remarkable performance gains of over 20% on the ViT model for CIFAR10, CIFAR100, and ImageNet-1k benchmarks. This systematic approach establishes new state-of-the-art performance while maintaining parameter efficiency, proving particularly effective when labeled data is scarce.
Jun 1, 2026

Query-Limited Community Recovery in Stochastic Block Models

We study exact community recovery in the two-community stochastic block model on nn vertices under limited and noisy access to network data. The learner may query a noisy neighborhood oracle that reveals each true neighbor of a queried vertex independently with fixed probability and never returns non-neighbors, subject to a finite query budget. We consider both oracle-only access and a combined model where the learner also observes a single subsampled copy of the underlying graph. For oracle-only access, balanced uniform querying gives a sharp non-adaptive benchmark: when each vertex is queried the same integer number of times, the observations reduce to an SBM with attenuated edge probabilities and the Abbe-Bandeira-Hall exact-recovery threshold applies. We show that this benchmark is not adaptively optimal: a two-stage adaptive strategy succeeds with n+o(n)n+o(n) queries in a regime where balanced uniform querying requires mnm n queries for some m>1m>1. With an additional subsampled graph, we prove a sublinear-query adaptivity gap: balanced data-independent uniform querying with a sublinear budget does not improve over the subsampled graph alone, whereas adaptive querying can target a small set of uncertain vertices and achieve exact recovery. Thus adaptive data acquisition can strictly improve the information-theoretic limits of exact recovery.
May 30, 2026

Active Learning with Foundation Model Priors: Efficient Learning under Class Imbalance

Real-world datasets across image and text domains are often characterized by skewed class distributions and noisy annotations, which jointly degrade model performance, particularly on minority classes. Among existing solutions, active learning offers an effective and efficient paradigm by selectively querying the most informative and balanced samples for annotation. We propose an innovative active learning framework that mitigates class imbalance and selects the most informative samples to annotate. Leveraging foundation model priors, our algorithm enables imbalance-aware co-decisions between foundation model and small model to tackle noisy and imbalanced labels across various domains. We introduce the first study to systematically explore active learning under the dual challenges of label noise and class imbalance across image and text domains. Extensive experiments on imbalanced datasets demonstrate that our method achieves substantial annotation savings-over 50% compared to the best active learning baseline-while preserving performance and robustness to label noise.
May 30, 2026

Distributed GNEP Algorithms without Multiplier Sharing and Applications to Multi-Robot Coordination and Contextual Bandit-Based Active Learning

Recent advances in artificial intelligence have expanded the focus from classical optimization to include equilibrium analysis in noncooperative games. Many such games involve shared constraints, leading to Generalized Nash Equilibrium Problems (GNEPs). Existing distributed algorithms typically require agents to exchange Lagrange multipliers to enforce consensus and compute variational-GNEs (v-GNEs). This work introduces fully distributed continuous-time algorithms and establishes convergence without requiring multiplier exchange, thereby reducing information exchange per iteration while improving privacy preservation. The analysis focuses on strongly monotone games with convex individual constraints and linear shared constraints. I also propose several discretization schemes for the continuous-time algorithms. The proposed approach converges to general GNEs, rather than being restricted to v-GNEs, with the attained equilibrium depending on the initialization. The effectiveness of the proposed method is demonstrated through applications in multi-robot coordination and placement. In the second part, this work includes research conducted in collaboration with Amazon scientists. One of the most challenging problems in real-world machine learning is labeled data collection, which typically requires substantial human effort and cost. Active learning aims to reduce this labeling requirement. Existing handcrafted active learning strategies, however, generally perform well only on specific types of datasets, which are often unknown in advance. In this work, I propose using contextual bandits to adaptively select the most suitable active learning strategy. The effectiveness of the proposed approach is demonstrated on publicly available external datasets.
May 28, 2026

Active Timepoint Selection for Learning Measure-Valued Trajectories

Inferring continuous probability paths from sparse snapshots is a fundamental challenge in domains like single-cell biology, where high-fidelity data acquisition is often destructive and constrained by prohibitive sequencing costs. This motivates the need for active learning strategies to strategically select optimal measurement times. However, designing active learning policies for this setting remains an open problem: the target objects reside on the infinite dimensional Wasserstein space where standard Euclidean metrics are ill-defined, and current interpolation methods lack epistemic uncertainty quantification. We introduce a framework which extends active experimentation to the space of measures. By leveraging Linearized Optimal Transport (LOT), we map distributional snapshots into a tangent space amenable to Gaussian Process modeling, allowing us to construct a tractable probabilistic surrogate for the underlying probability path. This yields an acquisition policy that iteratively selects measurement times to minimize uncertainty. Empirical results demonstrate that our strategy outperforms uncertainty-agnostic baselines on both synthetic and real-world datasets.
May 28, 2026

Active Continual Learning with Metaplastic Binary Bayesian Neural Networks

Always-on edge systems must keep learning as conditions change under tight compute budgets and must detect unreliable predictions. Bayesian binary neural networks are attractive in this setting, but mean-field Bernoulli posteriors can saturate on long non-stationary streams, wiping out epistemic uncertainty and freezing plasticity. We propose BiMU, derived from a bounded-memory variational objective that balances stability, plasticity, and forgetting. BiMU combines a data term with controlled relaxation toward the prior and an uncertainty-dependent step size that prevents saturation and sustains informative uncertainty. This non-degenerate posterior enables fully online, buffer-free active querying via Monte Carlo disagreement, reducing label queries and backpropagation updates under imbalance. BiMU sustains learning and strong OOD detection on 1000-tasks Permuted-MNIST, and on OpenLORIS-Object achieves up to 32×\times label/update savings at matched accuracy under class imbalance and feature compression.
May 28, 2026

User-Aware Active Knowledge Acquisition for Emotional Support Dialogue

Emotional support plays an important role in dialogue systems, and its success depends on adapting to a user's evolving and implicit needs across multi-turn interactions while leveraging the strong reasoning capacity of large language models. However, since signals about user needs are often weak, indirect, and can only be disambiguated through multi-turn interaction, existing emotional support methods often struggle to acquire and generalize relevant conversational knowledge efficiently. To bridge this gap, we introduce User-Aware Active Knowledge Acquisition (UKA), a gradient-free active dialogue learning framework that explicitly represents uncertainty about user needs and incorporates active learning into both knowledge acquisition and response selection.We propose a Theory-of-Mind uncertainty estimation mechanism that allows the model to prioritize responses, thereby eliciting more informative user feedback. UKA is capable of efficiently exploring user-aligned conversational knowledge during training while maintaining robustness at test time. Experiments across multiple dialogue benchmarks and model architectures demonstrate that our approach consistently outperforms strong baselines in dialogue quality and user alignment.
May 28, 2026

MetaRanker: Human-in-the-loop Active Ranking for Metalens Image Quality

Image quality in modern imaging systems emerges from the coupled effects of the sensor, optics, and computational reconstruction. Ultra-thin metalenses offer a path toward substantial miniaturization of optical modules, but practical designs often exhibit pronounced chromatic and field-dependent aberrations that necessitate computational reconstruction. In current metalens pipelines, reconstruction models are commonly trained and selected using distortion-based fidelity objectives, such as PSNR, yet these proxies can be weakly correlated with human preference and downstream utility, reflecting the well-known perception--distortion trade-off. We introduce MetaRanker, a human-in-the-loop active ranking framework that formalizes metalens image quality in terms of semantic interpretability, defined as the degree to which humans can reliably recognize objects and structures in the presence of optical artifacts. MetaRanker combines a probabilistic preference model with uncertainty-aware query selection, and leverages vision--language models to provide lightweight semantic priors. Importantly, these priors are used only to guide the sampling of informative comparisons; human judgments remain the primary supervision signal throughout. Across real-world and synthetic metalens datasets with distinct degradation profiles, MetaRanker produces rankings that align most closely with human assessments, while reducing the number of pairwise annotations required by approximately 80% relative to exhaustive pairwise evaluation. Finally, we show that standard image quality assessment metrics exhibit limited alignment with human interpretability in the metalens domain, positioning MetaRanker as a practical step toward perceptually grounded metalens evaluation and co-design.
May 27, 2026

Theoretical Foundations and Effective Algorithms for Policy-Aware Simulator Learning

Model-based reinforcement learning (MBRL) agents typically learn world models by minimizing predictive loss. However, powerful RL optimizers inevitably exploit minor model inaccuracies, leading to simulator exploitation and a reality gap where policies succeed in simulation but fail in the real world. We propose that the objective for learning simulators should be strategic robustness rather than predictive accuracy, and formulate this as a zero-sum minimax game between a model player and an adversarial policy player. We provide a comprehensive theoretical analysis: (1) an online learning guarantee showing the game is learnable with sublinear regret bounds; (2) a tractable critic-based simplification bounding the global policy-value gap by the local critic's loss; and (3) an Error-MDP duality, proving that finding the worst-case policy is formally dual to a standard RL problem where the reward is the one-step critic error. This duality yields a provably convergent active data selection algorithm. Experiments on continuous control tasks demonstrate that our approach reduces prediction error in strategically important regions by 1.51.5-2.2×2.2\times and enables policies trained purely in simulation to match near-optimal real-world performance.
May 25, 2026

Active Query Synthesis for Preference Learning

Efficient learning of user preferences is crucial for many modern decision making systems but typically requires costly labeled data. Active learning reduces this cost, yet standard methods are computationally expensive due to pool-based evaluation. Further, most methods assume all query feedback is equally reliable, ignoring that pairwise queries between nearly identical or entirely dissimilar items yield ambiguous, low-confidence responses. To address the issue of feedback reliability, we introduce a novel confidence aware response model that explicitly accounts for these ambiguous comparisons. To overcome the computational bottleneck of pool-based evaluation, we propose an active query synthesis framework, Info-Synth that generates optimal queries by maximizing a mutual information-based objective within a continuous space. Moreover, we propose two strategies, Pair M-dist and Pair Opt-dist, that extend Info-Synth to select effective queries even when restricted to finite query pools. We demonstrate our framework's versatility and performance across synthetic preference learning, constrained text summary datasets, and subjective, continuous-space controller gain tuning for a simulated mobile robot.
May 25, 2026

Adaptive Graph Refinement and Label Propagation with LLMs for Cost-Effective Entity Resolution

Dirty entity resolution (ER), which identifies records referring to the same real-world entity from a single, messy dataset, is a fundamental task in data management and mining. However, the dominant blocking-matching-clustering paradigm for ER suffers from critical flaws. Its cascaded, decoupled workflow essentially produces a static, sparse graph plagued by missing edges (due to blocking failures) and noisy links (due to matching errors), causing error propagation and yielding suboptimal clusters, particularly when rigid transitivity is imposed in the clustering. We contend that matching and clustering are fundamentally synergistic, both optimizing for the construction of an ideal entity graph. Building upon this insight, we propose Alper, a unified framework that integrates these steps into an iterative probabilistic label propagation process over a global, evolving graph. Unlike disjoint blocking, Alper refines the graph structure and labels dynamically by adaptively integrating "weak but cheap" signals from graph propagation with "strong but expensive" LLM-based pairwise queries. For higher cost-effectiveness, we formulate the signal selection as a constrained optimization problem maximizing cumulative marginal gain under a query budget, solved via our greedy algorithm with provable theoretical guarantees. Our extensive experiments over eight benchmark datasets demonstrate that Alper is consistently superior to state-of-the-art cascaded pipelines.
May 24, 2026

Large Language Model Selection with Limited Annotations

Choosing a Large Language Model (LLM) for a given task requires comparing many strong candidates, yet standard evaluation relies on costly annotations over fixed evaluation sets. To address this challenge, we develop SELECT-LLM, the first framework for active model selection of LLMs. SELECT-LLM aims to find a small set of queries whose annotations are most informative for identifying the best LLM for a given task. To this end, we introduce a query selection rule based on expected information gain, computed from pairwise similarities between candidate model outputs. Because this rule only uses generated model responses, SELECT-LLM can be applied across candidate models without assumptions about their architecture or access to model weights. This makes it suitable for both open-weight and black-box LLMs. We evaluate SELECT-LLM across 23 datasets, 156 evaluated models, diverse task families, and multiple text evaluation metrics. Across all experiments, SELECT-LLM improves over the strongest baseline in every setting, with annotation cost reductions up to 81.8% for best model selection and up to 84.78% for near-best model selection.
May 24, 2026

Active Learning for Stochastic Contextual Linear Bandits

A key goal in stochastic contextual linear bandits is to efficiently learn a near-optimal policy. Prior algorithms for this problem learn a policy by strategically sampling actions but naively (passively) sampling contexts from the underlying context distribution. However, in many practical scenarios -- including online content recommendation, survey research, and clinical trials -- practitioners can actively sample or recruit contexts based on prior knowledge of the context distribution. Despite this potential for active learning, the role of strategic context sampling in stochastic contextual linear bandits is underexplored. We propose an algorithm that learns a near-optimal policy by strategically sampling rewards of context-action pairs. We prove instance-dependent theoretical guarantees demonstrating that our active context sampling strategy can improve over the minimax rate by up to a factor of d\sqrt{d}, where dd is the linear dimension. We show empirically that our algorithm reduces the number of samples needed to learn a near-optimal policy, in tasks such as warfarin dose prediction and joke recommendation.
May 23, 2026

AvAtar: Learning to Align via Active Optimal Transport

Alignment plays a fundamental role in many machine learning problems, such as multi-network analysis, multimodal learning, and point cloud registration. Recent works increasingly leverage optimal transport (OT) for distributional alignment, whose effectiveness largely depends on sparse supervision that is hard or costly to obtain in practice. Existing works, however, largely overlook how to actively acquire high-quality supervision to improve their alignment performance under OT frameworks. In this paper, we propose a principled active alignment framework for optimal transport alignment called AvAtar. We quantify the informativeness of a candidate by measuring its gradient-based impact on the global alignment result, computed as the gradient propagation from the global alignment result to all possible supervisions of the candidate through the entropy-regularized OT formulation. While differentiating through OT is challenging given its constrained nature, we leverage the adjoint-state method to reformulate the computation to a linear system solvable by the conjugate gradient method with linear complexity and guaranteed convergence. By encoding the global alignment result via effective utility functions, AvAtar is applicable to general alignment problems under the OT framework. Extensive experiments on three representative alignment tasks demonstrate the effectiveness, scalability, and generalizability of the proposed AvAtar.
May 21, 2026

Balancing Uncertainty and Diversity of Samples: Leveraging Diversity of Least, High Confidence Samples for Effective Active Learning

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.
May 20, 2026

Beyond Scalar Objectives: Expert-Feedback-Driven Autonomous Experimentation for Scientific Discovery at the Nanoscale

Self-driving laboratories or autonomous experimentation are emerging as transformative platforms for accelerating scientific discovery. Bayesian optimization (BO) is among the most widely used machine learning frameworks for these purposes, but these BO-based frameworks rely on predefined scalar descriptors to guide experimentation. In many situations, the determination of an appropriate scalar descriptor can be challenging, and may fail to capture subtle yet scientifically important phenomena apparent to experts with interdisciplinary insight. To overcome this limitation, here we develop deep-kernel pairwise learning (DKPL), an approach for autonomous microscopy experiments which incorporates human expertise and interdisciplinary scientific knowledge into an active learning loop. Instead of relying on explicit scalar objectives, DKPL enables experts to directly evaluate which experimental output is more promising using interdisciplinary knowledge. DKPL then learns a latent utility function from these expert judgements to guide subsequent autonomous microscopy experiments. We demonstrate DKPL's performance in learning physically meaningful nanoscale structures while effectively prioritizing high-information measurement regions using an experimental model dataset with known ground truth. We further apply DKPL to analyze the character of ferroelectric domain walls, where we find DKPL capable of distinguishing between high and low characteristic domain-wall angles in bismuth ferrite, and able to discover both head-to-head and tail-to-tail domain-wall character in erbium manganite. This development establishes an approach to integrate expert knowledge into autonomous microscopy experiments and demonstrates a pathway toward expert-guided self-driving laboratories capable of addressing scientific problems beyond the limits of scalar-metrics-driven learning.
May 20, 2026

Data-Efficient Neural Operator Training via Physics-Based Active Learning

Solving partial differential equations with neural operators significantly reduces computational costs but remains bottlenecked by high training data requirements. Active learning offers a natural framework to mitigate this by selectively acquiring the most informative samples in an iterative manner. We introduce physics-based acquisition - a novel physics-informed active learning algorithm that leverages the partial differential equation residual to guide data selection. We validate the method by presenting numerical experiments for the 1D Burgers equation and the 2D compressible Navier-Stokes equations. We show that, in our experiments, physics-based acquisition consistently outperforms random acquisition and matches the state of the art in data efficiency. At the same time, it has the unique advantage of injecting a physics inductive bias into the training process, ensuring that simulation cost is spent where the model's physical understanding is weakest.
May 20, 2026

Cumulative Meta-Learning from Active Learning Queries for Robustness to Spurious Correlations

Spurious correlations in real-world datasets cause machine learning models to rely on irrelevant patterns, undermining reliability, generalization, and fairness. Active learning offers a promising way to address this failure mode by querying informative samples that distinguish core features from spurious ones. However, standard active-learning methods simply append queried examples to the labeled set, effectively updating only the likelihood term. In deep learning regimes, the influence of these informative samples can be diluted by the larger labeled set and memorized by overparameterized models. We propose Cumulative Active Meta-Learning (CAML), an active-learning framework that uses queried examples to meta-learn the prior, or inductive bias, governing how the model adapts. CAML casts each active-learning round as a meta-learning task: the current labeled set serves as meta-train data for adaptation, while the newly queried batch serves as meta-test data for evaluating generalization. Unlike conventional meta-learning, which treats tasks as independent and identically distributed, CAML exploits the sequential dependence between active-learning rounds by maintaining a cumulative inductive bias that is progressively refined. Theoretically, we show that this cumulative formulation introduces interaction terms that couple earlier meta-learned inductive biases with later query-induced objectives, capturing dependencies absent from standard meta-learning. Empirically, CAML improves minority-group accuracy across spurious-correlation benchmarks and acquisition strategies, with gains of up to 27.8% on Dominoes, 29.9% on Waterbirds, 14.3% on SpuCo, and 24.0% on CivilComments.
May 14, 2026

A Mutual Information Lower Bound for Multimodal Regression Active Learning

Active learning for continuous regression has lacked an acquisition function that targets epistemic uncertainty when the predictive distribution is multimodal: variance misses modal disagreement, and information-theoretic targets like BALD are designed for discrete outputs. We introduce a Two-Index framework that makes this separation explicit: one stochastic index selects among competing model hypotheses (epistemic source), while a second governs within-hypothesis randomness (aleatoric source). An entropy decomposition within the framework identifies the mutual information between the output and the epistemic index as a principled acquisition objective, and we prove this quantity vanishes as the model is trained on growing datasets, confirming that it captures exactly the uncertainty data can resolve. Because this mutual information is intractable for continuous outputs, we derive the Mutual Information Lower Bound (MI-LB) acquisition function, a closed-form approximation for Mixture Density Network ensembles. On benchmarks featuring multimodal systems, MI-LB matches or beats every baseline evaluated and is the only method to do so consistently -- geometric and Fisher-based baselines compete only when the input space already encodes the multimodality, and collapse otherwise.
May 14, 2026

Are Candidate Models Really Needed for Active Learning?

Deep learning has profoundly impacted domains such as computer vision and natural language processing by uncovering complex patterns in vast datasets. However, the reliance on extensive labeled data poses significant challenges, including resource constraints and annotation errors, particularly in training Convolutional Neural Networks (CNNs) and transformers due to a larger number of parameters. Active learning offers a promising solution to reduce labeling burdens by strategically selecting the most informative samples for annotation. However, the current active learning frameworks are time-intensive which select the samples iteratively with the help of initial candidate models. This study investigates the feasibility of using CNNs and transformers with randomly initialized weights, eliminating the need for initial candidate models while achieving results comparable to active learning frameworks that depend on such candidate models. We evaluate three confidence-based sampling strategies: high confidence (HC), low confidence (LC), and a combination of high confidence in the early stages of training and low confidence at later stages of training (HCLC). Among these, mostly LC demonstrated the best performance in our experiments, showcasing its effectiveness as an active learning strategy without the need for candidate models. Further, extensive experiments verify the robustness of the proposed active learning methods. By challenging traditional frameworks, the proposed work introduces a streamlined approach to active learning, advancing efficiency and flexibility across diverse datasets and domains.
May 14, 2026

AQKA: Active Quantum Kernel Acquisition Under a Shot Budget

Estimating an N×NN \times N quantum kernel from circuit fidelities requires Θ(N2S)Θ(N^2 S) measurement shots, the dominant bottleneck for deployment on near-term hardware. Existing budget-saving methods (Nyström-QKE, ShoFaR, kernel-target alignment) sub-sample which entries to measure but allocate shots uniformly within their chosen subset, ignoring how much each entry drives the downstream classifier. We close this gap with two contributions. First, a complete regime decomposition for shot-budgeted quantum kernel learning: a principled menu of when each allocator wins. Our method, AQKA, dominates the budget-limited regime (B≲16npairsB \lesssim 16 n_{\mathrm{pairs}}) on sparse-sensitivity KRR, with the gap growing from +8+8 to +25+25 pts over uniform as NN scales 225→1000225{\to}1000 and reaching +26+26--3232 pts on an ibm\_pittsburgh (156-qubit Heron) hardware kernel; Nyström-QKE wins at saturating budgets on planted-sparse via low-rank reconstruction; ShoFaR is competitive only at extreme low budgets. Second, a closed-form pair-level acquisition theory: sij⋆∝∣gij∣Kij(1−Kij)s_{ij}^{\star} \propto |g_{ij}|\sqrt{K_{ij}(1-K_{ij})} with explicit gradient gijg_{ij} for KRR (Lemma1, ∣βiαj+βjαi∣Kij(1−Kij)|β_iα_j+β_jα_i|\sqrt{K_{ij}(1-K_{ij})}) and SVM via the envelope theorem (∣ηi∗ηj∗∣Kij(1−Kij)|η_i^*η_j^*|\sqrt{K_{ij}(1-K_{ij})}); a corrected sparsity-aware Cauchy--Schwarz rate ρ≤2m/Nρ\le 2m/N matching empirics (vs.\ the naive m2/N2m^2/N^2); an explicit-constant plug-in regret bound (Theorem2); and a tighter SVM ceiling ρSVM≤msv2/N2ρ^{\mathrm{SVM}} \le m_{\mathrm{sv}}^2/N^2. We close with the first multi-seed live online adaptive shot allocation on quantum hardware: +17.0±4.8+17.0 \pm 4.8 pts at N=20N{=}20 on ibm\_aachen (3.5σ3.5σ, 5 seeds), with the advantage holding at N=30N{=}30 at higher budget on ibm\_berlin (+14.0±8.5+14.0 \pm 8.5 pts, 5 seeds).
May 14, 2026

Active Learners as Efficient PRP Rerankers

Pairwise Ranking Prompting (PRP) elicits pairwise preference judgments from an LLM, which are then aggregated into a ranking, usually via classical sorting algorithms. However, judgments are noisy, order-sensitive, and sometimes intransitive, so sorting assumptions do not match the setting. Because sorting aims to recover a full permutation, truncating it to meet a call budget does not produce a dependable top-K. We thus reframe PRP reranking as active learning from noisy pairwise comparisons and show that active rankers are drop-in replacements that improve NDCG@10 per call in the call-constrained regime. Our noise-robust framework also introduces a randomized-direction oracle that uses a single LLM call per pair. This approach converts systematic position bias into zero-mean noise, enabling unbiased aggregate ranking without the cost of bidirectional calls.
May 13, 2026

Force-Aware Neural Tangent Kernels for Scalable and Robust Active Learning of MLIPs

Active learning for machine-learning interatomic potentials (MLIPs) must address several challenges to be practical: scaling to large candidate pools, leveraging energy-force supervision, and maintaining robustness when candidate pools are biased relative to the target distribution. In this work, we jointly address these challenges. We first introduce a linearly scaling acquisition framework based on chunked feature-space posterior-variance shortlisting. By avoiding materialisation of the candidate and train set kernels, this approach enables screening of ~200k structures within hours and applies broadly to acquisition strategies that score candidates based on molecular similarity metrics. We then extend the Neural Tangent Kernel (NTK) to a force-aware setting via mixed parameter-coordinate derivatives, yielding a force NTK and a joint energy-force NTK that provide natural similarity metrics for vector-field prediction. We demonstrate the effectiveness of the joint energy-force NTK on the OC20 dataset, where force-aware acquisition is crucial: it achieves the lowest energy and force MAE and RMSE across all metrics and distribution splits. Across T1x, PMechDB, and RGD benchmarks, our force NTK methods remain competitive with established baselines while being significantly more efficient than committee-based approaches. Under a controlled candidate-pool shift case study on T1x, acquisition based on pretrained MLIP embeddings and NTKs remains robust, whereas committee-based methods exhibit higher variance. Overall, these results show that a single pretrained MLIP can enable scalable, force-aware, and distribution-robust active learning for foundation-model fine-tuning.