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Collecting computer use data from human demonstrations is expensive and slow, motivating the need for scalable generation strategies. This requires two key ingredients: environments in which agents can act and verifiers that can judge whether their demonstrations succeeded. We introduce FaraGen1.5, a scalable data pipeline for computer use agents composed of three modular components: environments, solvers, and verifiers. FaraGen1.5 uses both live websites and synthetic environments that faithfully simulate domains gated by authentication or that require irreversible actions. It employs a solver harness that can be powered by multiple models, including strong frontier models such as GPT-5.4, and also incorporates a user simulator to enable multi-turn rollouts. Finally, FaraGen1.5 scores the resulting trajectories with three complementary verifiers covering task correctness, efficiency, and critical-point adherence. Using data produced by this pipeline, we train Fara1.5, a family of native computer use agents (CUAs) at three scales built on Qwen3.5 (4B, 9B, and 27B). To train these models, we employ a supervised finetuning (SFT) recipe that carefully balances data from FaraGen1.5 for broad coverage, specific high-value tasks, and target model deficiencies in an iterative approach. Each model sets a new state of the art for its size class on browser-use benchmarks: Fara1.5-9B reaches 63.4% on Online-Mind2Web and 86.6% on WebVoyager, while Fara1.5-27B achieves 72.3% on Online-Mind2Web, which is competitive with much larger proprietary systems.

Variational quantum circuits (VQCs) are parameterized quantum circuits optimized classically. We propose a hybrid variational quantum circuit (HVQC) extending VQCs with a classical affine post-measurement layer, enabling vector-valued regression without the linear overhead of independent scalar circuits. Theoretically, we show that elementary one-and two-qubit circuits can approximate quadratic functions and products via data re-uploading and entanglement, providing the foundations of the full architecture. Experimentally, on two synthetic image reconstruction datasets and the Friedman1 benchmark (40,568 test samples), our HVQC matches Gaussian Process Regression and outperforms XGBoost and Random Forest. An ablation study confirms that both quantum and classical components are essential, and results highlight the central role of the feature map in hybrid quantum-classical models.

Multimodal forecasting models that combine time series with text annotations promise richer prediction through textual context, but how do we know whether a text annotation meaningfully contributes to the forecasters prediction? This is an information-theoretic question, but to evaluate whether information-theoretic metrics can reliably measure the predictive value an annotation provides, a ground truth benchmark is needed, and none currently exist. We create a synthetic time series signal with annotations in three categories: semantically correct, incorrect, and irrelevant. Because the data generation process is fully controlled, ground-truth information content is known exactly, enabling principled evaluation of six complementary mutual information estimators (KSG, MINE, InfoNCE, CCA, PID and V-information). We show that all six estimators identify correct annotations as most informative, and are able to audit the quality of mixed text corpora, choosing the annotations that result in the best downstream forecasting results without the need for model training. Our benchmark identifies limitations of each estimator, and these are validated on seven real-world datasets, which show how estimator performance differs on weak signals. Finally, we establish practical rules for implementing these metrics for annotation auditing and fusion selection.

Personalization algorithms determine what content users encounter on online platforms. Auditing these systems is difficult because independent auditors have only black-box access to the algorithms, while personalization depends on users' attributes, behavior, and evolving interaction histories. Existing auditing methods face a tradeoff: studies with real users capture realistic behavior but are costly and hard to control, whereas sock-puppet audits scale more easily but often rely on scripted behavior that limits realism. Beyond this, both approaches struggle to decouple user attributes from user behavior, limiting our ability to causally understand personalization. To address this gap, we introduce a framework for black-box audits of personalization algorithms using generative AI agents as behavioral engines for synthetic accounts. Each agent is instantiated with a fixed persona, grounded in demographic and political survey data, and interacts with a platform's content by reasoning about it and choosing actions. Because behavior is fixed within each persona while platform-visible signals such as age, gender, or location can be experimentally perturbed, our design enables counterfactual auditing of how platforms respond to user attributes. As a case study, we deploy 1,120 agents on X shortly after the 2024 U.S. election, spanning 14 personas and three counterfactual conditions, collecting over 200,000 content exposures. We find that X's algorithmic feed amplifies toxic, polarizing, political, and right-leaning content relative to the chronological feed, with amplification varying sharply by user ideology. Counterfactual analyses show that demographic signals affect content delivery in persona-dependent ways: pooled effects are largely null, while subgroup-level effects vary in direction and magnitude. Our work establishes GenAI-based agents as a new tool for algorithmic auditing.

Traditional insurance pricing relies on risk-based principles that ensure actuarial fairness and solvency but do not explicitly account for policyholders' price sensitivity. We formulate insurance pricing as a decision-making problem and study it using tools from off-policy evaluation and stochastic control. We propose a kernelized inverse propensity score estimator that exploits local structure in the action space and yields variance reduction compared to the classical inverse propensity score estimator. Building on these value estimates, we investigate policy optimization and present two practical approaches for computing optimal pricing rules: an interpretable data-shared Lasso formulation and a flexible policy parameterization based on neural networks. Using a controlled synthetic travel insurance environment, we empirically confirm the theoretical results and show that neural networks outperform existing techniques for policy optimization.

This study investigates active flow control (AFC) of a 30P30N high-lift wing at a Reynolds number Re$_c$ = 450,000 and angle of attack $α$ = 23$^\circ$ using wallresolved large-eddy simulations (LES). Two optimization strategies are explored: open-loop Bayesian optimization (BO) and closed-loop deep reinforcement learning (DRL), both targeting the mitigation of stall and the improvement of aerodynamic efficiency via synthetic jets on the slat, main, and flap elements. The uncontrolled configuration was validated against literature data, confirming the reliability of the LES setup. The BO framework successfully identified steady jet velocities that increased efficiency by +10.9% through a -9.7% drag reduction while maintaining lift. In contrast, the DRL agent, despite leveraging instantaneous flow information from distributed sensors, achieved only minor improvements in lift and drag, with negligible efficiency gain. Training analysis indicated that the penalty-dominated reward constrained exploration. These results highlight the need for carefully designed rewards and computational acceleration strategies in DRL-based flow control at high Reynolds numbers.

Lung cancer remains the leading cause of cancer-related mortality worldwide, with survival outcomes critically dependent on early and accurate detection. When low-dose computed tomography (LDCT) findings are indeterminate, clinicians typically defer diagnosis pending follow-up CT imaging obtained up to 12 months later, inevitably delaying treatment for patients with malignant nodules. To address this clinical gap, we propose Nodule-Aligned Multimodal (Latent) Diffusion (NAMD), a novel generative framework that synthesizes one-year follow-up nodule CT images conditioned on the baseline CT scan, quantitative nodule biomarkers, and patient-level Electronic Health Records (EHR), enabling timely prediction of nodule malignant progression without requiring actual follow-up scans. NAMD introduces two key contributions: (i) a nodule-aligned latent space regularized so that embedding distances reflect clinically meaningful biomarker changes, and (ii) an LLM-driven multimodal conditioning mechanism encoding heterogeneous EHR data into the diffusion backbone. Evaluated on the National Lung Screening Trial (NLST), our method's synthetic follow-up images achieve an AUROC of 0.805 and an AUPRC of 0.346 for lung nodule malignancy prediction, outperforming both the baseline LDCT performance without virtual follow-up generation, and existing state-of-the-art conditional generation methods, while maintaining competitive image quality. These findings suggest that NAMD enables earlier and more accurate lung cancer diagnosis by capturing clinically meaningful features of nodule progression.

A growing number of neural architectures have been proposed to enforce geometric constraints, including projection-based networks, exponential-map updates, constrained output layers, and manifold neural ODEs. We provide a unified framework for these geometry-preserving architectures by organizing them according to where and how constraints are enforced, either throughout the intermediate layers or only at the final output. This perspective reveals several gaps in the existing theory. To address these gaps, we prove high-level approximation theorems for projected neural ODEs, intermediate augmented architectures, and final augmented architectures on prox-regular constraint sets, including smooth manifolds with boundary. Numerical experiments on synthetic dynamics over S^2, the disk, SO(3), together with real-world protein backbone data on SE(3), demonstrate exact feasibility for analytic updates and show that the final augmentation have simpler architecture and outperform in most tasks considered. When the constraint set is unknown, we learn projections via small-time heat-kernel limits, showing diffusion/flow-matching can be used as data-based projections. Moreover, we also the demonstrate the usefulness of the architectures that enforce non-convex constraints for path planning on manifolds with boundary.

Guided wave-based structural health monitoring (GWSHM) with onboard transducers offers significant potential for the early diagnosis of damage in engineering structures. However, the practical deployment of deep learning models is often hindered by the limited availability of labelled experimental data and the high computational cost of generating large-scale high-fidelity simulation datasets. This study presents a multifidelity transfer learning framework that integrates lightweight physics-based simulations, convolutional autoencoder (CAE)-based deep feature learning, a feed-forward neural network, and limited experimental measurements for accurate damage localisation and sizing in plate-like structures instrumented with piezoelectric transducers. A computationally efficient one-dimensional time-domain spectral element model is employed to generate a large synthetic dataset for pretraining, while transfer learning adapts the model to experimental domains using only a small amount of labelled data. The CAE-based transfer learning framework significantly outperforms its CNN-based counterpart in damage localisation accuracy. The model achieves excellent predictive performance with $R^2$ scores exceeding 0.93 for damage localisation and 0.99 for damage sizing. Its generalisation capability is demonstrated on previously unseen data, showing high prediction accuracy for damage scenarios not represented during pretraining or fine-tuning. The results establish the proposed framework as an accurate, computationally efficient, and practically viable solution for real-world GWSHM applications.

Serialization formats designed for document interchange impose structural overhead that becomes prohibitive when large language models consume operational data at scale. A modest dataset of 1,000 IoT sensor readings serialized as JSON requires approximately 80,000 tokens - the majority spent on repeated field names, nested braces, and structural punctuation rather than semantic content. We present ONTO (Object Notation for Token Optimization), a columnar notation that declares field names once per entity and arranges values in pipe-delimited rows with indentation-based hierarchy. This schema-once, data-many design eliminates per-record key repetition while preserving human readability and nested structure support. Evaluation across three synthetic operational datasets demonstrates 46-51% token reduction versus JSON, with stable scaling from 100 to 1,000 records. Controlled inference benchmarks on Qwen2.5-7B show corresponding 5-10% latency improvement. Comprehension validation confirms no material degradation in LLM task accuracy across lookup, counting, extraction, and aggregation operations when format context is provided. Ablation analysis reveals that key repetition accounts for the majority of JSON overhead, with indentation costs in nested structures explaining the 4-percentage-point gap between flat and hierarchical data. ONTO occupies a previously unfilled position in the serialization landscape: columnar efficiency with hierarchical structure, optimized for LLM context windows rather than document interchange. Code and specification are available at https://github.com/harsh-aranga/onto.

Maritime anomaly detection is essential for ensuring maritime safety, security, and efficient traffic management at sea, with Automatic Identification System (AIS) data serving as a primary data source. Despite its importance, most publicly available AIS datasets lack predefined anomaly labels, forcing prior studies to rely on either distribution-based rarity or domain rule/expert-assisted labeling. These approaches, however, face fundamental limitations: statistical rarity often fails to reflect practically critical events, while expert-based labeling is costly, subjective, and difficult to scale. Moreover, both paradigms tend to overlook interaction-driven hazards such as near-miss approaches between vessels. To address these challenges, we propose an equation-grounded anomaly taxonomy that is implementable under a limited AIS observation schema and extensible to other AIS datasets. Specifically, the taxonomy defines three anomaly types: unexpected AIS activity (A1), route deviation (A2), and close approach (A3), covering both single-vessel and inter-vessel anomalies. Building on this taxonomy, we introduce a unified score-synthesize-label pipeline that produces LLM-guided plausibility scores, uses them to synthesize anomalies, and assigns timestamp-level labels. To rigorously assess detection performance, we further design benchmark evaluation settings that account for variations in temporal-window length and anomaly-type composition, and evaluate a broad range of time-series models and anomaly detection models. Together, these contributions provide a systematic basis for evaluating maritime anomaly detection methods across different anomaly types. Our code is available at https://github.com/snudial/open-maritime-anomaly-detection.

Predicting biomolecular properties from limited labeled data is a central bottleneck in protein engineering and small-molecule design. As strong pretrained encoders now supply rich fixed-length representations, the difficulty has shifted from representation learning to building a data-efficient predictor for the few-shot regime. Tabular foundation models such as TabPFN and TabICL are unlikely candidates for this role: they are in-context learners pretrained on synthetic tables drawn from random causal graphs, a generative prior with no obvious correspondence to the processes that produce protein sequences or molecular graphs. That this tabular, causal inductive bias should transfer to biomolecular data at all is counter-intuitive, yet we find it does. Treating each method as a predictor-representation pair, we evaluate across two domains. We find that on protein fitness regression tasks these in-context learning models coupled with ESM Cambrian representations achieve or exceed state-of-the-art results on ProteinGym, and outperform task-specific supervised regressors on a diverse esterase catalytic activity dataset. For small-molecule classification with ECFP/RDKit descriptors, no single predictor-representation pairing dominates across TDC ADMET, MoleculeNet, FS-Mol, and DrugOOD, but they are competitive with the existing task-specific state-of-the-art. Crucially, on both protein and small-molecule few-shot tasks, these predictor-representation pairs offer strong performance. We conclude that tabular foundation models can be strong biomolecular predictors, but only when coupled with expressive representations.

Conformal changepoint localization turns any score into a confidence set for the changepoint with finite-sample coverage. Coverage is universal; efficiency is not. The oracle score is a likelihood ratio, so practical scores estimate density ratios, and set length deteriorates under heavy tails, skewness, and distribution shift, where no length guarantee applies. We propose ARC (Augmented-Rank Conformalization), a family of scores depending on the data only through within-segment ranks: rank-CUSUM location and scale channels, their fixed combinations, and a lightweight neural score frozen after synthetic training. Every ARC score inherits finite-sample coverage for every frozen weight configuration, including random initialization and mistraining. The main result is an efficiency transfer theorem: the entire ARC confidence set is almost surely invariant under strictly increasing marginal transforms, so the set length distribution depends on the data pair only through its rank structure, and lengths certified once hold verbatim across its monotone orbit, whereas a plug-in score's length changes with every re-expression. Across different rank structures lengths do change, and are reported as such. Classical rank-test theory positions ARC as targeting the optimal invariant score at bounded cost. Simulations confirm nominal coverage for all scores, including sabotaged networks, identical sets under monotone transforms where plug-in scores inflate, and smooth degradation where plug-in sets become vacuous; on the well-log benchmark ARC localizes annotated shifts to three to five candidates and flags misfit by an empty set. Two boundaries are stated rather than hidden: serial dependence destroys exactness, and trend-type alternatives lie outside the piecewise-exchangeable model.

With the rapid development of deep generative models, forged facial images are massively exploited for illegal activities. Although existing synthetic face detection methods have achieved significant progress, they suffer from the inherent limitation of overconfidence due to their reliance on the Softmax activation function. Thus, these methods often lead to unreliable predictions when encountering unknown Out-of-Distribution (OOD) images, and cannot ascertain the model's uncertainty in its prediction. Meanwhile, most existing methods require massive high-quality annotated data, which greatly limits their practicability across diverse scenarios. To address these limitations, we propose EMSFD (Evidence-based decision Modeling for Synthetic Face Detection with uncertainty-driven active learning), an approach designed to enhance detection reliability and generalizability. Specifically, EMSFD models class evidence using the Dirichlet distribution and explicitly incorporates model uncertainty into the prediction process. Furthermore, during training, the estimated uncertainty is exploited to prioritize more informative samples from the unlabeled pool for annotation, thereby reducing labeling cost and improving model generalization. Extensive experimental evaluations demonstrate that our method enhances the interpretability of synthetic face detection. Meanwhile, our method yields a 15% increase in accuracy compared to existing state-of-the-art (SOTA) baselines, which demonstrates the superior detection performance and generalizability of our approach. Our code is available at: https://github.com/hzx111621/EMSFD.

Recent Relational Deep Learning architectures have been proposed as foundation models for multi-table relational data, yet they impose constrained neighborhood budgets that force row truncation when an entity has many related records. We introduce Animus, a synthetic financial dataset in which predicting customer income requires aggregating up to tens of thousands of transactions. On the raw representation, three recently proposed models (RT, Griffin, RelGT) achieve $R^2 \le 0.18$; a single, routine, temporal pre-aggregation step recovers $R^2$ up to $0.65$. This questions whether current relational foundation models are ready for high-cardinality real-world data.

Classifying cybersecurity vulnerabilities using the Common Weakness Enumeration (CWE) taxonomy is challenging due to extreme class imbalance and strong hierarchical dependencies among weakness categories. Although oversampling techniques such as Synthetic Minority Oversampling Technique (SMOTE) and Adaptive Synthetic Sampling (ADASYN) are widely adopted to mitigate class imbalance, their effectiveness for hierarchical CWE text classification remains largely unexplored. This paper proposes a Hierarchy-Aware RoBERTa framework that explicitly incorporates CWE structural information through learnable parent-class embeddings, preserving taxonomic consistency. Our experiments demonstrate that synthetic interpolation in high-dimensional embedding spaces violates the inherent parent-child constraints of the CWE hierarchy, offering only marginal benefits for classical ML models while consistently degrading deep learning architectures. Evaluated on a CWE Research Concept dataset, the proposed model achieves a weighted F1-score of 0.76 without data augmentation, outperforming all baselines with notable gains on minority classes, including the Class category whose F1-score improved from 0.40 to 0.60 over the BERT baseline. Our results suggest that hierarchy-aware representation learning is a more principled alternative to oversampling for structured vulnerability classification.

Visual grounding in documents is a crucial ability for Large Multimodal Models (LMMs) in areas such as document understanding, deep research and document error detection. However, existing approaches exhibit poor grounding precision in text-rich document images, often failing to accurately locate the critical document elements needed for reliable reasoning. To address this gap, we introduce PreciseDoc, an LMM specifically designed for precise element grounding and can be further optimized for Document VQA tasks. Specifically, to enhance the basic localization capability, we construct challenging training data by two pipelines capable of mass-producing high-quality documents with paired metadata of fine-grained coordinates, including synthetic hand-filled documents with camera effects. The model develops more real-world functions beyond straightforward localization of single text, such as locating personal information from CVs. Furthermore, we introduce a training paradigm for visual grounded reasoning where the grounding and reasoning are supervised jointly with reinforcement learning to improve the contribution of the grounded evidence. A comprehensive evaluation on various benchmarks demonstrates the advantage of the proposed data and methods in document spatial grounding and document understanding.

Language models are playing an increasingly important role in laboratory science, performing tasks such as experiment planning, execution, and post-hoc analysis. However, precisely measuring their abilities is difficult, as scientific capabilities require a mixture of both problem-solving skills and domain-specific intuition. Existing evaluations rarely measure the capabilities required to make reliable decisions in a physical laboratory and often rely on public data that may have appeared in model training corpora. We introduce onepot-Bench 0, a proprietary benchmark suite for evaluating language models on synthetic chemistry capabilities relevant to wet-lab execution. onepot-Bench 0 comprises three complementary evaluations: ChemAbacus measures tool-free cheminformatics literacy and numerical reasoning; SynthRefusal characterizes safety and refusal behavior across a variety of benign, controlled, and designer-drug targets; and SynthBench evaluates reaction-outcome prediction and catalyst selection using private experimental data generated in our laboratory. Together, these evaluations probe basic competency, reliability, and deeper knowledge, all skills which are required for reliable performance in the lab.

We revisit dataset distillation from an outcome-centric perspective. Rather than aligning process surrogates (per-step gradients or training trajectories), Influence Matching (Inf-Match) aligns the final outcome of training: it learns a compact synthetic set whose effect on the converged parameters matches that of the full dataset. Concretely, we introduce a fully differentiable, sample-level influence estimator that quantifies parameter shifts from adding or removing data, without time-consuming inverse-Hessian products or convexity assumptions. The estimator runs in linear time by unrolling the optimization dynamics and applying a first-order Taylor approximation. We then learn the synthetic set by minimizing the mismatch between its influence and that of the real dataset, yielding outcome alignment rather than heuristic process imitation. Inf-Match delivers the best accuracy across standard classification benchmarks. For instance, on Tiny-ImageNet (IPC=10), Inf-Match attains 31.5%, a +4.7% improvement over NCFM. Beyond classification, Inf-Match scales to vision-language distillation on Flickr30K, outperforming strong process-matching baselines. For instance, with 200 to 1000 synthetic samples, our method achieved a leading impressive average on image/text retrieval tasks, higher than NCFM by 2.5%. The code will be released via https://github.com/hrtan/infmatch.

While Large Language Models (LLMs) excel in many general NLP tasks, their formal reasoning capabilities are often compromised by content effects, demonstrating a measurable bias towards real-world plausibility. In this paper, we present our system for SemEval-2026 Task 11, which evaluates the ability of models to disentangle formal logic from content across 12 languages with and without distractor premises. We address this challenge using mDeBERTa-v3 networks fine-tuned on a synthetic, rule-based dataset of syllogistic schemes to avoid the semantic noise of LLM-augmented data. To explicitly decouple plausibility from logical structure, our training pipeline employs a multi-objective loss function combining Adaptive Group Distributionally Robust Optimization (DRO), a scheduled differentiable bias penalty, and KL-Divergence consistency regularization. Our system achieved #1 ranks and perfect Ranking Scores (100.0) with 0.00% bias and 100.0% accuracy on Subtask 1 (English), Subtask 2 (Noisy English), and Subtask 3 (Multilingual). On the highly complex Subtask 4 (Noisy Multilingual), the system achieved the 6th rank with 89.06% Accuracy and F1-score, alongside a limited 2.89% Bias and a 37.78 Ranking Score. Our dataset generation engine and codebase are publicly available to facilitate future work on robust logical reasoning.

This paper introduces a family of multiclass linear Perceptron classifiers with a multiplicative margin mechanism (MMPerc), as an alternative to standard margin-free and additive margin Perceptrons. The multiplicative formulation enforces classification confidence by requiring the true class score to exceed that of competing classes by a specified fraction of itself, rather than by a fixed additive threshold. This avoids dependence on score magnitudes arising from varied norms of data and class weight vectors. We propose several architectural and algorithmic variants of MMPerc, derive associated loss functions and mistake bounds for both linearly separable and non-separable data, and analyze key design considerations, including bias, margin threshold selection, and training modes. Extensive experiments on synthetic and real datasets show that MMPerc classifiers typically outperform the standard Perceptron, as well as classic baselines such as Support Vector Machines and Ridge classifiers. Owing to their simplicity, minimalistic design, and computational efficiency, MMPerc classifiers are promising candidates for conventional machine learning tasks, linear evaluation of Deep Neural Networks, integration with Hyperdimensional Computing / Vector Symbolic Architecture representations, and deployment in resource-constrained applications.

When an AI system is deployed, the individuals who use and or are evaluated by it form beliefs about how the system operates and use those beliefs to strategically present their preferences, behaviors, or attributes. The system then responds with feedback or a decision outcome, thereby creating a human-AI interaction loop. This thesis studies how to design and shape such interactions to achieve three goals: (1) help individuals develop accurate beliefs about the AI systems so they can improve and or secure favorable outcomes at minimal cost, (2) encourage improvement and or discourage gaming behaviors, and (3) ensure that the AI system continues to achieve its intended objectives, such as maximizing accuracy. To address these goals, the thesis is organized into three complementary parts that examine and study human-AI interactions from the perspectives of both evaluated individuals and AI systems. Together, the work presented in this thesis advances human-centered machine learning by providing principles and methods for designing AI systems that align with human needs, values, and capabilities. Methodologically, this thesis integrates theoretical analysis, data-driven modeling, human-subject experiments, and empirical evaluations on real-world and semi-synthetic datasets.

Forecasting multiple time-series with high-dimensional covariates presents a core challenge: unifying common temporal patterns while retaining meaningful series-specific information. We introduce Hopformer (Homogeneity-Pursuit Transformer), a two-stage framework that addresses this challenge. In the first stage, we perform a Sparsity Pattern Aggregation (SPA) scheme extracting a common low-variance trend that incorporates the covariates. This acts as a homogenization layer. In the second stage, a LoRA-fine-tuned Transformer models the remaining complex dependencies in the residual. Our method is theoretically grounded. We prove that SPA achieves a near-optimal bias-variance trade-off via an oracle inequality. We also provide generalization bounds for the second stage under dependent time series data. Hopformer sets a new state of the art, improving MASE by an average of 6.56% across synthetic and real-world forecasting benchmarks.

Scaling semiconductor quantum dot arrays toward fault-tolerant quantum computing requires efficient tuneup of spin qubits, a process that depends on the analysis of charge stability maps (CSMs) and remains largely manual. While machine learning has been widely applied to CSM analysis in reservoir-coupled devices, automated tuning in the increasingly important isolated-mode regime has received limited attention. In isolated-mode CSMs, charge transitions appear as near-vertical lines, making them well suited to compact, task-specific models. We present two convolutional neural networks with fewer than one million parameters, trained on CSMs collected from 32 silicon metal-oxide-semiconductor (SiMOS) double-quantum-dot devices measured at approximately 1 K using an automated cryogenic probing system. Sixteen devices were used for training and sixteen were held out to evaluate cross-device generalization against hand-labeled ground truth. CSMClassifier identifies charge instability and sensor artifacts, achieving 94% macro-averaged accuracy across three quality classes on 2,407 held-out images. ChargeLineNet localizes charge-transition lines and determines electron occupancy, achieving 95.3% exact line-count accuracy on 1,131 held-out images. Combined into a single pipeline, the models correctly determine electron occupancy for 93.8% of clean held-out images. Pre-training on synthetic images substantially improves label efficiency. Fine-tuning the pre-trained model on limited experimental data maintains over 90% accuracy, whereas training from scratch degrades significantly under the same conditions. Together, the two models occupy only 6.5 MB and process images in less than 60 ms on standard laboratory hardware, demonstrating a practical path toward scalable, automated characterization and tuneup of quantum-dot devices.

LLM agents increasingly act as personal assistants that must remember a user's profile over months: who they are (attributes), what they routinely do (habits), and what they prefer (preferences), and keep it updated as jobs, routines, and tastes drift. Existing benchmarks evaluate this "memory" ability through short, simplified interactions, missing three core properties of real behavior: the profile is heterogeneous, with attributes, habits, and preferences evolving on different timelines; changes are driven by external context such as seasons and life events; and evidence is rarely stated explicitly, instead scattered across many small actions in different apps that a memory system must infer from. We introduce DynamicMem, a synthetic benchmark that constructs 15 months of activity per user, providing long-term multi-app data that real users' privacy keeps out of reach. It provides user-consistent trajectories averaging 2.2M tokens and 1,772 grounded events per user across 16 applications such as e-commerce, fitness, and social platforms. The profile evolves over this period and is never given explicitly: each attribute, habit, or preference must be inferred from small signals scattered across apps. We evaluate at five quarterly checkpoints to track how systems scale as history grows. Benchmarking five representative systems exposes problems a single accuracy score hides: (i) profile reconstruction degrades with history length while service-task accuracy stays flat, despite both drawing on the same memory; (ii) no system both keeps facts that stay true and replaces facts that change, with errors clustering on preferences and on naming the exact referent; and (iii) over 93% of failures trace to what the memory retrieves, not to the model writing the answer, so the largest room for improvement lies in memory itself. Code: https://wenyaxie023.github.io/DynamicMem/

Modern machine learning progresses through empirical work, benchmarking new methods to evaluate relative performance. However, the statistical variability inherent to evaluation - exacerbated by the stochastic nature of many algorithms - often makes performance estimation unreliable due to the limited test samples available, leading to a validation crisis in which genuine advances are difficult to discern. In this work, we show that cross-validation improves markedly confidence when evaluating and comparing learning algorithm performances. We introduce the concept of sample gain, which quantifies the virtual data augmentation achieved by using multiple cross-validation splits to reduce benchmarking variance. Experiments on both synthetic and real-world datasets (histopathologic scans and NLP fine-tuning) demonstrate that multiple splits can substantially improve the reliability and stability of performance estimates, with diminishing returns often setting in later than expected. We also introduce a procedure to dynamically early-stop cross-validation by estimating from the first few folds if subsequent folds will bring large sample gains. Our findings highlight the value of pushing cross-validation on available samples to achieve robust and reliable benchmarking.

Longitudinal treatment decisions from multivariate time-series data require predicting potential outcomes under future treatment sequences in the presence of time-varying confounding, heterogeneous patient dynamics, and limited domain-specific data. Existing longitudinal causal estimators typically address this problem by training a new model for each cohort or simulator. We introduce Causal Longitudinal Prior-Fitted Networks (CausalLongPFN), a prior-fitted network for time-series causal inference in longitudinal treatment-response data and zero-shot in-context counterfactual outcome prediction. The model is pretrained entirely on synthetic episodes sampled from a broad prior over temporal structural causal models, exposing it to treatment-confounder feedback, latent heterogeneity, nonlinear state evolution, delayed effects, and cumulative treatment responses. At test time, CausalLongPFN remains frozen and is used zero-shot: it conditions on support trajectories, a query history, and a planned future treatment sequence, and returns a predictive distribution over future outcomes without gradient updates or propensity-model fitting. Multi-step predictions are obtained by recursively applying the one-step predictor under the specified treatment sequence. We evaluate the model on branchable cancer, HIV, and warfarin benchmarks with ground-truth counterfactual labels, and on factual-only rolling-origin prediction in MIMIC-III ICU trajectories. CausalLongPFN is competitive with domain-trained longitudinal baselines on counterfactual benchmarks and performs strongly on factual MIMIC-III prediction, suggesting that broad synthetic causal pretraining can provide a frozen, amortized alternative for zero-shot longitudinal treatment-response prediction when repeated domain-specific training is costly or impractical.

Audio-language models (ALMs) are increasingly used in real-world applications that require understanding music, from music tutoring and transcription to captioning, recommendation systems, and music production. More broadly, they are becoming an important component of multimodal AI systems that must reason from sensory input rather than text alone. This makes reliable musical perception a critical prerequisite: if a model cannot accurately hear the structure of sound, it cannot be trusted to reason about, teach, transcribe, or act on audio in the real world. Yet existing benchmarks rarely assess one of the most fundamental musical abilities underlying such perception: pitch hearing. Current evaluations tend to probe pitch hearing only indirectly, through higher-level tasks and often in multiple-choice formats, leaving open how reliably ALMs identify fine-grained pitch across instruments, acoustic conditions, and response formats. We introduce PitchBench, an evaluation suite that systematically measures pitch hearing in ALMs. PitchBench comprises 28 experiments spanning absolute and relative pitch perception within sequences and chords, while varying loudness, note duration, sound source, time stretching, background noise, and other acoustic conditions. Tasks range from identifying individual pitches in isolation to tracking a melodic line within a four-part musical texture. Evaluating frontier ALMs, we find that pitch hearing remains highly unreliable: models perform consistently poorly across settings, with accuracy varying sharply by sound source, note duration, and notation format. Current ALMs do not yet possess stable pitch perception, even for controlled synthetic and instrumental stimuli. Alongside the benchmark, we release PitchBench as a Python package containing the evaluation data and data generation tools to support future work on pitch-aware audio-language modeling.

Nucleic acids are increasingly recognized as therapeutic targets beyond conventional protein-centered drug discovery, yet accurate and efficient docking of small molecules to nucleic acid structures remains challenging. Physics-based docking methods often show limited accuracy and efficiency, whereas deep learning approaches are constrained by the scarcity of experimentally resolved nucleic acid-ligand complexes. Here, we present NucleoDock, a deep learning framework for nucleic acid-small molecule docking. To address data scarcity, NucleoDock combines physics-guided large-scale pretraining on millions of docking-generated synthetic complexes with fine-tuning on curated experimental co-crystal structures. It further integrates sequence- and structure-informed nucleotide representations with atomistic three-dimensional features to capture both biological context and binding-site geometry. A mixture density network-based geometric scoring head is used to model conditional interaction-distance distributions for pose ranking. On an external benchmark of 125 nucleic acid-ligand complexes, NucleoDock achieved a top-1 success rate of 56 percent at an RMSD cutoff of 2.0 Angstrom, outperforming rDock with 29 percent, while generating 100 poses in approximately 5 seconds per complex. Retrospective virtual screening on the ROBIN benchmark further showed improved early enrichment. NucleoDock represents a step toward bridging the methodological gap between protein- and nucleic acid-directed computational drug discovery.

We address out-of-distribution (OOD) detection across the full spectrum of distribution shifts -- global domain changes, semantic divergence, texture differences, and covariate corruptions -- through a multi-encoder fusion of per-encoder representation-space diffusion models (RDMs). We statistically identify each encoder's sensitivity to specific shift types from ID data alone and introduce EncMin2L -- an encoder-agnostic two-level $\min(\cdot)$-gate that combines and calibrates per-encoder diffusion-based likelihood detectors without OOD labels, outperforming monolithic multi-encoder baselines at $2.3\times$ lower parameter cost. Two ID-data diagnostics: $η^2$ (class-conditional F-test) and $Δμ$ (log-likelihood shift under synthetic corruptions) -- quantify encoder specialization, while a Tippett minimum $p$-value combination aggregates per-encoder scores into a single, calibration-stable OOD signal. EncMin2L achieves $\geq 0.94$ AUROC across all four shift types simultaneously, outperforming the state-of-the-art representation-space diffusion OOD detectors across overlapping benchmarks.