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All fields2019Multimodal337Frontier LLMs260Recursive self improvement215Inference & serving167Agents & indirect prompt injection160Neural operators140Robotics138Clinical reasoning126Forecasting time97Linear bandits70Voice AI60AI safety36Character recognition OCR35Molecular property prediction34Federated learning28All 23 fields

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Papers

  • arXiv cs.LGSep 28

    One Sequence, Many Decodings: CAGenMol-2 Recasts Drug Design as Masked Molecular Inference

    Yanting Li, Enyan Dai, Lei Wang, Wen-Cai Ye, Li Liu

    Drug design couples property evaluation, conditional generation, structure-based design, and local optimization, yet machine learning systems typically address these capabilities with separate task-specific models. We introduce CAGenMol-2, a masked diffusion molecular language model that represents molecules, continuous scalar properties, and 3D protein pockets within a single wrapped sequence. Within this pretrained interface, downstream operations are selected by which sequence regions are observed or masked at inference, allowing one checkpoint to perform property prediction, property- and pocket-conditioned generation, and partial-constraint design without task-specific architectures or backbone fine-tuning. We further propose Adaptive Fragment Optimization (AdaFO), a gradient-free mask-and-refill search that turns the masked decoder into an iterative local molecular optimizer. On CrossDocked2020, AdaFO increases Success Rate from 30.2\% to 70.8\%, the best reported under this protocol, while largely preserving drug-likeness and diversity. Finally, scaffold-preserving directional editing and CRBN/VHL case studies demonstrate its use in compound design workflows spanning local…

    AI30PDF
  • arXiv cs.ROSep 28

    When World Models Lie: Adaptive Safety Analysis Under Wrong Imaginations

    John Cao, Somil Bansal

    World models offer a powerful substrate for safety reasoning in high-dimensional robotic systems, but they are also fallible: their predictions can be biased, miscalibrated, or confidently wrong. This creates a central challenge for latent-space safety filters, which often learn Hamilton-Jacobi safety value functions on the dynamics of a world model. If the world model is incorrect, the resulting value function can inherit its errors and produce overconfident safety estimates. Existing latent safety filters often rely on auxiliary signals such as ensemble disagreement or value-target consistency residuals for adaptation, but these signals can remain small even when the world model's predictions deviate from observations. We propose an adaptive latent safety filter that calibrates safety reasoning using directly observed world-model error. Our method uses Adaptive Conformal Inference to construct online uncertainty sets from discrepancies between predicted and observation-inferred latent states, then evaluates safety pessimistically by minimizing the learned value function over these sets. This allows the filter to remain minimally conservative when the world model is accurate,…

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  • arXiv cs.CVSep 28

    PSM: Dataset Distillation Based on Precise Statistical Matching by Difficulty

    Hongxu Ma, Guang Li, Shijie Wang, Dongzhan Zhou, Suorong Yang +4

    Dataset distillation (DD) condenses a large original dataset into a small distilled dataset with high training utility. Decoupled statistical matching methods substantially reduce distillation time and memory overhead while achieving strong performance. However, they typically supervise all distilled samples using running statistics estimated from the entire original dataset. These statistics mainly capture the average feature distribution while overlooking differences in sample difficulty, limiting their ability to characterize the difficulty structure of the original data. To address this issue, we propose Precise Statistical Matching (PSM) by difficulty. After pretraining, PSM uses the Global Precision Score (GPS) to estimate image difficulty, ranks the samples within each class, and partitions each class into IPC (images per class) difficulty groups. During distillation, Statistics Updated Again (SUA) updates the teacher's batch normalization (BN) running statistics through forward passes on original samples from each group, providing difficulty-specific supervision for the corresponding distilled batch. Meanwhile, Initial Sample Screening (ISS) initializes distilled samples…

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  • arXiv cs.CLSep 28

    Dr.Credit: Rubric-Grounded Process Credit Assignment for Deep Research Agents

    Yingjian Zhu, Zhenyi Wang, Jiaxin Guo, Kun Ding, Ying Wang +4

    Rubric-based tasks are increasingly addressed through reinforcement learning (RL), with rubric scores used as training rewards. However, these rewards typically supervise final answers without distinguishing the contributions of intermediate decisions. Many existing credit assignment methods rely on ground-truth answers to define process rewards, limiting their applicability to open-ended tasks without canonical solutions. To address this limitation, the proposed rubric-grounded credit uses task requirements as a shared reference for final answer evaluation and process supervision. The information returned by tools is assessed for the additional support it provides toward satisfying each rubric relative to that rubric's history of accepted support. By referencing these histories, credit distinguishes new support from evidence already present in the trajectory while recognizing partial support for each rubric. Dr.Credit uses rubric-grounded credit to supervise intermediate tool turns in an RL framework for deep research agents. The resulting process advantages are combined with GRPO outcome advantages to guide research decisions while retaining supervision of final-report quality.…

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  • arXiv cs.CVSep 28

    Semantic Modality Compensation for Unsupervised Visible-Infrared Person Re-identification under Unpaired Settings

    Duanning Chen, Ke He, Bin Yang, Yongxiang Yao

    Unsupervised visible-infrared person re-identification (USL-VI-ReID) learns person representations that can be compared across modalities without identity annotations. In the unpaired setting, however, identity correspondences between modalities are often incomplete, leaving many identities without an observed counterpart in the other modality. Existing unpaired methods bridge this gap by generating or mapping features for the other modality, mainly by exploiting the statistics of visual features without explicitly separating content that is discriminative for identity from style that is specific to modality. Consequently, the generated features may distort identity cues or inherit bias from the source modality, undermining the reliability of supervision across modalities. We formulate unpaired learning across modalities as a semantic compensation problem and propose Semantic Modality Compensation (SMC), a framework based on prompt composition that decouples identity semantics from modality style within a shared visual semantic space. SMC first constructs a discriminative ReID space through augmented dual contrastive learning, yielding pseudo labels, cluster prototypes, and…

    AI20PDF
  • arXiv cond-mat.dis-nnSmall LLMsSep 28

    Pre-registered tests of solid-state-physics-inspired LLM compression: a cluster-level negative result at small-language-model scale

    Jun-qiang Lu

    We report a three-month autonomous research-agent program testing five solid-state-physics-inspired compression mappings on pretrained language models, with predictions committed to git before any pilot data and a 3-sigma gate deciding PASS or SHELVE. The common anchor -- area-law / Kohn-nearsighted decay of the one-particle density matrix -- has a distance face (P001 Wannier, P002 tight-binding) and a rank face (P003 DMRG-truncated MLPs, P005 Wilson-RG, P011 tensor-train embeddings). P005 was pre-empted at Phase 1; three of four Phase-3 pilots were falsified. On the attention face, GPT-2-medium attention-versus-distance is best fit by a stretched exponential in 12 of 16 median-layer heads once probe padding is excluded, and a tight-binding cutoff costs +96% perplexity (P002); on Pythia-160M the Wannier sparsity 0.054 +/- 0.004 is indistinguishable from PCA, random-Haar and identity baselines (P001). On the rank face, per-token tensor-train bond dimension does not track surprisal (r = 0.016 vs a pre-registered 0.65) and the format inflates rather than compresses (P011). P003 is mixed: its scaling claim shelved (r = -0.434), its MPO premise died at stage-0, and its cross-paper…

    AIEvals50PDF
  • arXiv cs.CLTraining & fine-tuningSep 28

    ReScraper: Unified Scraping and Cleaning of Web Data for Effective LLM Pretraining

    Zichun Yu, Jiarui Yan, Shlok Sanghvi, Nihar Atri, Chenyan Xiong

    LLM pretraining corpora are normally cleaned by a stack of hand-written heuristics. A heuristic scraper extracts the main content from HTML, and dozens of rule-based filters then clean it, so corpus quality is capped by the coarseness and accuracy of the rules. In this work, we propose ReScraper, a unified language model of only 0.6B parameters that replaces this entire stack. To train ReScraper, we carefully curate supervised data from the outputs of three teacher models, so it learns to first extract the main content from raw data and then choose among four operations: keeping the page as extracted, editing out noisy lines and spans, deleting it entirely, or rewriting it when it is poorly written but informative. Based on the same crawled data pool, pretraining 400M, 1.4B, and 2.8B models on our curated data improves the DCLM Core score by a relative 3.8--4.7% over the strongest baseline at each scale, including the costly multi-agent curation. Our analyses show that each operation plays a distinct and complementary role, and that extracting and cleaning in one model outperforms a cascade of separate models. ReScraper also concentrates its operations on the pages that need…

    AI90PDF
  • arXiv cs.CVRoboticsSep 28

    Dexterous Tactile World Model

    Ziyao Zeng, Xiatao Sun, Hao Wang, Yueyang Pan, Zhengxiang Yu +4

    World models for manipulation are typically trained from video, yet the events that determine how manipulation unfolds, such as making and releasing contact, are difficult to observe visually and are often easier to sense through touch. We present the Dexterous Tactile World Model (DTWM), a video world model for future-frame prediction of egocentric manipulation from both observed video and tactile signals from a glove worn on each hand. We condition a pretrained video diffusion transformer on each hand's tactile signal through a zero-initialized residual at the corresponding hand location in the video tokens, while a causal mask prevents predicted frames from accessing future information. Compared with a vision-only model matched in architecture, parameters, and training, DTWM reduces the underestimation of hand motion from 23% to 9%, while reducing the perceptual error in the hand region by 7.4% across three training runs per model. The benefit also increases over the prediction horizon, with the improvement in the later predicted chunks being about 4.1x larger than in the first. DTWM also outperforms other visual-tactile world models under the same setting, and training with…

    AIMultimodal70PDF
  • arXiv cs.LGSep 28

    Epistemic Learning from Imprecise Annotation

    Kaizheng Wang, Siu Lun Chau

    Imprecise annotations may support several plausible labelling distributions, yet learning methods often resolve this ambiguity into a single predictive distribution. This can obscure what the annotation evidence leaves unresolved. We introduce epistemic learning from credal supervision, a framework that uses convex sets of plausible labelling distributions, called credal sets, as supervision and learns sets of predictive distributions. We instantiate the framework with the pessimistic--optimistic credal classifier (POCC), which combines a shared backbone with two classification heads trained to minimise worst-case and best-case losses over the supervision sets. Their outputs define a predictive credal set whose spread provides an uncertainty score. We also show how credal labels can be obtained through a simple relaxation of existing probabilistic labels, reducing commitment to their precise probability assignments. This construction admits closed-form inner optimisation under cross-entropy loss, enabling efficient training. Assuming the supervision sets contain the true conditional label distributions, and other regularity assumptions, we establish a finite-sample generalisation…

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  • arXiv cs.CLSep 28

    Over-Personalization Is a Decision Failure: Generation-Induced Apply Bias in LLMs

    Haeun Jang, Yonghyun Jun, Hwanhee Lee

    Personalized LLMs must decide, for each stored preference, whether the current context calls for applying or suppressing it, which we call its applicability. They frequently over-personalize, applying preferences the context rules out, yet existing benchmarks score only the final response and cannot tell where this failure arises. We decompose preference handling into three stages and measure each separately: (1) knowing whether a preference applies, (2) deciding on an explicit Apply/Suppress label, and (3) generating a response consistent with that label. Using linear probes, we first show that this applicability signal remains decodable from hidden states during generation. By making the decision explicit, we then find that in most settings wrong decisions faithfully followed outnumber correct decisions lost in generation. We thus locate the failure in the decision, which breaks once the model is also asked to answer. To determine whether this reflects lost sensitivity or a response bias, we propose ABIDE (Apply-Bias Investigation via Decision-score), which adapts signal detection theory to Apply-vs-Suppress decision scores read directly from logits. ABIDE reveals a…

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  • arXiv cs.LGAgentsSep 28

    Agentic High-Dimensional Bayesian Optimization with Hypothesis- and Evidence-Guided Search

    Zhixuan Gao, Ke Xue, Rongxi Tan, Ming Chen, Chao Qian

    High-dimensional Bayesian optimization (HDBO) seeks sample-efficient optimization when the number of variables is large relative to the evaluation budget. Recent LLM-based and agentic BO methods incorporate task knowledge and adapt search decisions during a run, but have primarily been evaluated on low- and moderate-dimensional problems. We ask whether this paradigm can transfer to the higher-dimensional regime. Our experiments show that these methods do not remain reliable in the high-dimensional regime, where the challenge is not only where to evaluate, but also which modeling assumption and search geometry to use when the objective's useful structure is unknown. We therefore introduce HERA, a Hypothesis- and Evidence-guided Research Agent that uses task context, optimization feedback, and structural diagnostics to revise search hypotheses, select and configure HDBO strategies, and determine their execution length. PRISM, its numerical optimization engine, generates and evaluates candidates sequentially within each search block, updating numerical models after each observation. HERA remains competitive with strong numerical HDBO baselines and outperforms the evaluated LLM-based…

    AIEvals60PDF
  • arXiv cs.AISep 28

    MoSPR: Histology-to-Gene Expression Prediction with Morpho-Spatial Macrostates and Low-Rank Molecular Programs

    Dongmyung Shin, Geongyu Lee, Yesung Cho, Park Jong Bae

    Predicting molecular profiles from histopathology remains challenging because whole-slide images contain spatially organized, heterogeneous tissue patterns, while gene expression comprises thousands of correlated targets. We introduce MoSPR (Morpho-Spatial Program Regression), a linear framework that couples an adjacency-informed histology representation with a low-rank molecular basis. MoSPR clusters frozen patch embeddings into morphology microstates, aggregates their spatial adjacencies across the training cohort, and groups microstates with similar adjacency patterns into shared macrostates. Each slide is then represented by global morphology and macrostate-specific deviations, which are linearly mapped to coefficients of a training-derived low-rank gene-expression basis. Across three cancer cohorts from The Cancer Genome Atlas, MoSPR achieves the highest mean gene-expression prediction scores among all evaluated methods. Without pathway-level supervision, pathway scores derived from its predicted expression profiles rank first in eight of nine comparisons across three pathway collections. Ablation studies on the breast cancer cohort show complementary gains from…

    AI20PDF
  • arXiv cs.LGTraining & fine-tuningSep 28

    Direct Self-Evolving Optimization: Evolving LLMs without Challenger Training

    Yuyang Deng, Yu Wang, Jiayun Wang

    Self-evolving language models improve by generating tasks and learning from their own feedback, but adapting the task generator often requires a separate challenger-training loop. Can we generate tasks adapted to the current solver without explicitly training a challenger? We introduce \textbf{D}irect Self-\textbf{E}volving \textbf{O}ptimization (DEO), which replaces challenger parameter updates with solver-guided task sampling. The KL-regularized challenger objective defines an exponential tilt of a fixed base task distribution. DEO uses this distribution as a sampling target: a frozen LLM generates and mutates tasks, the solver scores them, and an approximate Metropolis selection rule refines the training pool. Only the solver is trained. Theoretically, for an idealized variant that samples exactly from the tilted distribution, and under regularity, local gradient-dominance, and initialization conditions, we show that DEO learns distributionally robust reasoning ability. In experiments, DEO achieves reasoning performance competitive with R-Zero while using over $50\%$ less wall-clock training time, and improves reasoning accuracy over a no-walk ablation. Replacing the task…

    AIFrontier LLMs90PDF
  • arXiv cs.CVMultimodalSep 28

    See, Measure, and Reason: Learning Visually Grounded Reasoning in Pathology

    Chengyang Zhang, Wenchuan Zhang, Bo Li, Mengran Li, Xinyu Liu +6

    Pathological assessment relies on recognizing fine-grained visual details in histological images. Vision-language models (VLMs) increasingly support pathology interpretation, yet their ability to perceive these details remains inadequate. This weakness leads to inaccurate cellular observations that can persist even when final answers are correct. In this paper, we propose ASPECT to improve visually grounded reasoning through explicit supervision of cellular appearance and abundance. ASPECT trains intermediate visual tokens through pathology feature reconstruction, cell feature alignment, and count supervision. Three-stage supervised fine-tuning teaches the model to perceive, generate visual tokens, and reason, followed by reinforcement learning that rewards answer correctness and consistency with reported measurements. We also introduce PathoVernier, a benchmark of 759 expert-reviewed questions from five pathology datasets covering four cellular composition tasks. It evaluates both final answers and intermediate measurements to expose errors hidden by answer accuracy. On PathoVernier, ASPECT achieves relative accuracy gains of approximately 19.2% over the strongest baseline,…

    AIEvals80PDF
  • arXiv cs.AISep 28

    BIABench: Evaluating AI agents on real-world bioimage analysis tasks

    Zixuan Pan, Davide Panzeri, Lukas Johanns, Marilin Moor, Yu Zhou +3

    Artificial-intelligence (AI) agents hold promise for automating bioimage analysis, yet no benchmark evaluates whether they can carry out real-world analyses end to end. Such analyses are hard for agents because 2D images, 3D volumes and time-lapse sequences are often too large to read as context, so an agent must choose and run an analysis through code, specialized software and rendered views. Published studies make this capability testable, because each pairs raw images with a peer-reviewed result. We introduce BIABench, a benchmark of 16 tasks reconstructed from published biological studies that retain their scientific questions, imaging data and ground truth. The tasks span eleven analysis subtasks and modalities from H&E histology to single-molecule localization microscopy. Each submission receives an outcome score, which compares the output files with the ground truth using field-standard metrics, and a process score, in which a vision-language model judges method choice and quality control against an expert-written rubric. We evaluated general-purpose and biology-specific agents across several language models, with repeated runs of every task. Routine two-dimensional tasks…

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  • arXiv cs.AIFrontier LLMsSep 28

    Query Expansion and Key Specialization in Transformer Attention Geometry

    Vidit Gupta, Siddhesh Nadkarni, Mihik Chaudhari, Vinaya Sawant, Prachi Tawde

    The projection of queries and keys are central to the attention mechanism in Transformer architectures. While they are mathematically symmetric, they play different roles in attention mechanisms. The question of whether there is an effect from their functional distinction on their geometric development in training remains unanswered. We investigate the problem through the training of small GPT-like Transformers on character-level WikiText-103 for three different depths (4, 6, and 8 layers), three types of initialization for queries and keys, and four random seeds, resulting in 36 runs and 54 trajectories of average layers across seeds. We track the effective dimensionality of those layers using participation ratios and discover that effective dimension of queries expand while keys shrink, and that $PR_Q - PR_K$ is positive in all trajectories studied. In connection to attention, the shrinking of keys leads to a narrower spectrum of $QK^\top$ and more peaked attention weights. In order to determine if this connection is causal or coincidental, we directly control the spectrum of keys during training across five seeds: restricting it to make it shrink sharpens the attention with…

    AI60PDF
  • arXiv cs.LGInference & servingSep 28

    Broken Symmetry in BF16 Attention: Why FlashAttention Gradients Blow Up Late in Training

    Junlin Chen, Daize Dong, Huanwei Di, Haolong Jia, Jiawei Wu +7

    BF16 is now standard in large-scale pretraining, including in fused attention kernels such as FlashAttention, and these kernels are widely trusted. When we used FlashAttention-3 to pretrain a 450M-parameter transformer on 50B tokens, however, we ran into a problem: training was healthy for 25B tokens, then the gradient norm grew a thousandfold and the loss ended 0.2 nats above FP32 attention, without a single NaN. Recomputing the attention backward of just two layers in FP32 removes almost all of the excess gradient. Part of the cause is known: a fused multiply-add in the forward softmax, so far treated as an extreme-input NaN case and never fixed in FlashAttention-3. Repairing it stops the blow-up, but the query gradient is still wrong by more than its own size, and training still drives attention logits to thousands of times their size under accurate gradients. The remaining error comes from a broken conservation law. The softmax score gradient sums to zero along every row, which makes the query gradient blind to where the keys sit as a group; rounding it to BF16 leaves a small nonzero sum that leaks the mean key into the gradient, and the leak grows exactly as late training…

    AITraining & fine-tuning80PDF
  • arXiv cs.CVImage & video generationSep 28

    Scaling Versatile 3D Assets Editing with a Million-Scale Dataset

    Badi Li, Tianxin Huang, Yu Zhou, Wei-Shi Zheng, Yi Ma +1

    Although recent 3D generative models produce increasingly realistic assets, controllable 3D asset editing remains challenging. Existing methods are limited by scarce training data, insufficient source-aware modeling, and a lack of practical evaluation protocols. To address these limitations, we present Alchemy3D, a unified framework for training and evaluating versatile 3D asset editors that covers data construction, model architecture, and benchmark evaluation. Specifically, we curate Alchemy3D-1M, a large-scale 3D editing dataset containing 1.25M assets and 1.38M editing pairs across seven editing types. On this data, we train a family of generative flow models for general-purpose 3D asset editing. The model family supports image- and text-conditioned editing, few-step inference, and transfer to multi-view 3D part segmentation. We further introduce GEdit3D-Bench, a large-scale, open-world benchmark with a multi-dimensional evaluation protocol. Across existing and newly introduced benchmarks, our method outperforms prior methods on most metrics of editing fidelity, source preservation, and visual quality.

    AIEvals90PDF
  • arXiv cs.RORoboticsSep 28

    Bayesian Active Learning for Intent Disambiguation in Interactive Robot Planning

    Huao Li, Carson Sobolewski, Augustinos Saravanos, William Tan, John Karigiannis +1

    Interactive robot planning requires robots to infer and execute human intentions from natural language instructions that are often ambiguous, incomplete, or underspecified. Although large language models (LLMs) provide a powerful interface for clarification, relying on the generative model to drive an multi-turn conversation can introduce systematic failures. We propose a Bayesian framework that treats clarification as an active learning problem over grounded Signal Temporal Logic (STL) task specifications. Our method uses LLMs to initialize candidate formal specifications and translate informative contrasts into natural-language clarification questions, while Bayesian optimization maintains uncertainty estimation over user intent and selects queries that maximize information gain. After convergence, the inferred STL specification is passed to a formal planner to synthesize a verifiable robot trajectory. Across four simulated and real-world task domains, our approach generally achieves higher task satisfaction and requires fewer clarification rounds than LLM baselines, while helping smaller models close the performance gap against larger reasoning models.

    AIAgents75PDF
  • arXiv cs.ROSep 28

    SAGE: Symbolic Action-Gating and Editing for LLM Task Planners

    Trung Minh Bui, JongSul Moon, YoungOuk Kim, Quang-Ngoc Phung, Se-Woong Jun +1

    Large language models (LLMs) are now the default cognitive core of embodied household agents, yet the plans they emit are rarely checked against a grounded model of the environment before execution, and the task-success they report is often measured on benchmarks so saturated that no method can be separated from another. We present SAGE (Symbolic Action-Gating and Editing), a single-LLM planner built from two lightweight mechanisms: a domain-agnostic symbolic gate (~250 lines of Python, zero tokens, $O(|π|)$) that blocks precondition-violating actions with typed reasons as a runtime safety monitor, and a local edit that regenerates only the failed sub-goal's suffix, keeping completed and untouched work intact; a hybrid seed+live memory store supports cold-start coverage. We evaluate under a leak-free protocol (leave-one-out retrieval) over five open-weight models and a 75-task AI2-THOR benchmark. On the standard benchmark goal-completeness saturates (52% of instances trivially solved) and SAGE ties strong hierarchical baselines. On a harder, method-agnostic multi-goal composition, SAGE's completeness lead re-emerges large (+0.06 to +0.23 across four models). Under injected…

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Rising research topics

  • Diffusion priors20−4.8%
  • Character recognition OCR35−10.3%
  • Voice AI60−13.0%
  • Spiking neural networks6−25.0%
  • Quantum machine learning23−25.8%
  • Forecasting time97−32.2%
  • Channel state information14−33.3%
  • Molecular property prediction34−34.6%