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Dong Li

Publications and source records attributed to Dong Li.

At least 19 recordsLinked to original sources
arXiv2026

Autonomous Chemical Mechanistic Discovery through Agentic Reasoning and Validation

Unraveling reaction mechanisms is central to modern chemistry, yet automating these investigations remains challenging because computational workflows still rely heavily on expert intervention. Here we introduce ARCHE, an autonomous agentic system that integrates a general-purpose reasoning model, a domain-specialized computational chemistry model, and a structured tool registry to transform mechanistic inquiry into a scalable, self-validating process. ARCHE interprets scientific questions, generates and prioritizes mechanistic hypotheses, orchestrates computational workflows, and iteratively refines conclusions based on computed evidence within a closed loop. We validate its capabilities across three increasingly demanding scenarios: reconstructing stereocontrolling transition states and validating the corresponding reaction mechanism in a previously reported asymmetric catalytic reaction; proposing and validating a plausible radical pathway through iterative hypothesis refinement for a recently discovered but unpublished $\alpha$-iodoboronate C-I cleavage reaction; and identifying a chemically interpretable descriptor that governs selectivity in nickel-catalysed migratory cross-coupling reactions. By coupling agentic reasoning with rigorous computational validation, ARCHE advances autonomous mechanistic discovery and establishes a foundation for broader machine-assisted chemical research. The code for ARCHE is publicly available at https://github.com/JetAstra/Arche-Harness.

cs.AI↗
arXiv2026

On the Regularization Landscape for the Linear Recommendation Models

Recently, a wide range of recommendation algorithms inspired by deep learning techniques have emerged as the performance leaders on several standard recommendation benchmarks. While these algorithms were built on different DL techniques (e.g., dropouts, autoencoder), they have similar performance and even similar cost functions. This paper studies whether the models' comparable performance are sheer coincidence, or they can be unified under a single framework. We find that all linear performance leaders effectively add only a nuclear-norm based regularizer, or a Frobenius-norm based regularizer. The former ones possess a (surprising) rigid structure that limits the models' predictive power but their solutions are low rank and have closed form. The latter ones are more expressive and more efficient for recommendation but their solutions are either full-rank or require executing hard-to-tune numeric procedures such as ADMM. Along this line of finding, we further propose two low-rank, closed-form solutions, derived from carefully generalizing Frobenius-norm based regularizers. The new solutions get the best of both nuclear-norm and Frobenius-norm world.

cs.AI↗
arXiv2026

DriftParking: Trajectory Modeling via Drifting Field for End-to-End Automated Parking

Automated parking requires generating complete and executable trajectories in highly constrained spaces with low tolerance for goal pose error. Existing end-to-end parking methods struggle to jointly achieve inference efficiency, trajectory quality, and precise endpoint alignment, while conventional imitation objectives provide limited supervision on structured deviations from expert maneuver geometry. We propose DriftParking, a one-step trajectory generation framework that reconstructs the drifting-field paradigm for high-precision conditional trajectory generation. Specifically, we replace distribution-level attraction with conditional one-to-one attraction toward the paired expert trajectory, introduce expert-centered constructive repulsion, and adaptively attenuate repulsion near convergence. We further formulate trajectory generation in an endpoint-residual space by decomposing each trajectory into a start-to-goal baseline and a learnable residual, turning endpoint alignment into a representation-level structural constraint on the supervision target while providing a structured space for repulsive supervision. DriftParking achieves state-of-the-art performance across all evaluation metrics. Closed-loop on-vehicle experiments across diverse parking scenarios further show a 97% parking success rate, demonstrating strong zero-shot generalization.

cs.RO↗
arXiv2026

EraseSAE: Surgical Concept Erasure in Text-to-Video Diffusion Models via Sparse Autoencoders

Recent advances in text-to-video (T2V) diffusion models have demonstrated remarkable generative capabilities, yet their reliance on loosely curated training data raises pressing safety and copyright concerns. Concept erasure offers a principled remedy by removing unwanted semantics from pretrained models while preserving remaining concepts. However, existing approaches typically operate at a coarse granularity misaligned with the fine-grained, distributed nature of concept representations, leading to incomplete removal or degraded generation quality. We argue that surgical erasure fundamentally requires intervention at the level of monosemantic features, where each unit encodes a single interpretable concept. To this end, we propose EraseSAE, a novel framework that leverages sparse autoencoders to achieve surgical concept erasure in DiT-based T2V diffusion models via a principled decompose-attribute-erase pipeline. We first introduce the Partitioned Convolutional Sparse Autoencoder, which decomposes dense spatiotemporal activations into disentangled, interpretable sparse features while preserving spatiotemporal coherence. A contrastive attribution mechanism then contrasts activations from paired prompts to isolate concept-specific feature kernels. At inference, timestep-resolved spatiotemporal masks derived from the identified kernels confine erasure to regions where the target concept is active, leaving unrelated content intact. Extensive experiments across diverse diffusion models and concept erasure tasks demonstrate that EraseSAE achieves precise and robust concept removal with minimal quality degradation, substantially outperforming state-of-the-art methods. The code is available at https://github.com/HiDream-ai/EraseSAE.

cs.CV↗
arXiv2026

CATeye: Coupled Attribute-Topology Invariance Learning for Voucher Abuse Detection

Voucher abuse poses a major challenge in e-commerce, where malicious users exploit promotional vouchers for profit. Unfortunately, fraud patterns evolve rapidly over time and across regions, causing distribution shifts that degrade existing detection models unless retrained frequently. To tackle this, we propose the Coupled Attribute-Topology Invariance Learning framework (CATeye). The key challenge arises from coupled attribute-topology shift, where edges built from attribute proximity cause environment-driven attribute shift to induce shifted topology, thereby amplifying variant signals through GNN message passing. CATeye sees through such coupled shifts with two learnable selectors. First, an Attribute Invariance Selector (AIS) learns node-adaptive masks to filter out non-invariant attributes. Then, conditioned on retained invariant attributes, an Edge Invariance Selector (EIS) samples an invariant subgraph and isolates non-invariant edges. Using the resulting invariant and non-invariant components, CATeye constructs multiple views and applies view-specific objectives to emphasize domain-invariant representations while suppressing domain-specific variations. Experiments on both a proprietary dataset from Lazada, a major Southeast Asian e-commerce platform, and a public benchmark show that CATeye consistently outperforms nine strong domain generalization and graph anomaly detection baselines, achieving up to an 8.61% improvement in average F1 score over the strongest baseline. Source code is publicly available at https://github.com/Tian0426/CATeye.

cs.LG↗
arXiv2026

AgenticGen: Reward-Guided Agentic Video Generation for Advertising

Advertising video generation is not only a video synthesis task, but also a product-conditioned reasoning problem whose success is measured by online business metrics. Recent video foundation models can generate realistic clips from multimodal conditions, yet they do not optimize how a product should be transformed into an effective advertisement or how future generation should be improved from online business feedback. To close this loop, we propose AgenticGen, a reward-guided agentic framework that decomposes advertising video generation into two trainable reasoning stages, strategy selection and draft generation, thereby exposing optimization targets that online business feedback can supervise. AgenticGen learns a performance-based reward from accumulated online feedback and a complementary rubric-based reward aligned with human quality standards, then uses them to supervise policy optimization. DPO first moves the agentic policies toward online preferences, and GRPO further refines both stages with process and outcome rewards. Offline experiments validate the reward models and successive policy optimization. Online A/B experiments in the TikTok advertising system show that AgenticGen after DPO and GRPO improves CTR by 2.72%, CVR by 2.63%, and Advv by 9.61% over the SFT baseline.

cs.CV↗
arXiv2026

Coronary Mask Guided Registration for Continuous Time 4D Cardiac CT Dataset Construction

Objective: Clinical cardiac CT multiphase reconstructions generally provide acceptable image quality in end-diastole (ED) or end-systole (ES) phases, but in other phases may exhibit motion artifacts, especially in the right coronary artery (RCA). This limits ground-truth availability in 4D cardiac CT imaging research. We aim to construct a 4D cardiac CT dataset that is generally suitable to serve as pseudo ground truth. Methods: We propose Coronary Mask Guided Registration (CMGR) to produce a motion-preserved, artifact-reduced, and continuous-time 4D cardiac CT sequence from the clinical multiphase reconstruction of each patient. For artifact reduction, CMGR uses the ED or ES phase as the reference phase and warps the reference volume with deformation fields to produce the sequence. For motion preservation, CMGR registers the reference phase to each non-reference phase of the multiphase reconstruction. To capture the motion of both the RCA and other cardiac structures in each registration, CMGR regularizes RCA masks and incorporates them into image-domain registration. Time-continuity is achieved by interpolating the deformation fields for non-reference phases to arbitrary times. Results: CMGR outperformed representative image-domain registration methods in capturing RCA motion and providing reasonable RCA shape, and showed competitive performance in capturing whole-heart motion. Additionally, CMGR reduced motion artifacts from clinical multiphase reconstructions, and intermediate CMGR frames generally provided plausible transitions between discrete cardiac phases. Conclusion: CMGR provides an effective approach for constructing continuous-time 4D cardiac CT datasets. Significance: The dataset can be used in system design simulations and in reconstruction algorithm development, thereby facilitating advances in cardiac CT imaging.

eess.IV↗
arXiv2026

GraphMemix: Query-Aware Evidence Forests for Long-Term Multimodal Agent Memory

Organizing long-term memory for multimodal agents remains challenging because existing methods either suffer from expensive question-agnostic offline summaries or naive embedding similarity matching that introduces incomplete and redundant context. To address these issues, we propose GraphMemix, a combinatorial-optimization graph memory framework that models memory organization as query-aware evidence-forest construction. Specifically, our method consists of three key components:(1) candidate graph construction, which expands multi-view seed memories through schema and semantic relations to acquire query-aware original context; (2) evidence utility and activation costs, which decouples direct memory support from anchor-conditioned relation verification to suppress redundant or conflicting information; and (3) forest optimization, which jointly selects a forest-format memory context under a maximum evidence budget and its reliable relational structure. By organizing memory into a query-relevant subgraph, the method avoids substantial lifecycle cost and recovers low-similarity complementary evidence. Experimental results across four long-term multimodal memory benchmarks demonstrate significant improvements with different foundation models and establish a new Pareto frontier between accuracy and lifecycle cost.

cs.AI↗
arXiv2026

AsmEvo: Agentic Assembly-Level Optimization of AMD GPU Kernels with Functional Equivalence Verification

High-performance ML systems increasingly rely on GPU kernels whose editable source is unavailable, generated, or too distant from final machine code to expose remaining optimizations. Existing LLM kernel optimizers and autotuners mainly operate on CUDA, Triton, HIP, or tensor-program source and validate against reference implementations. We study a stricter setting: optimizing an already compiled AMDGPU code object, where the deployed binary is the only behavioral oracle. We present AsmEvo, an agentic assembly-level optimizer for AMD GPU kernels. Given an AMDGPU code object K0, AsmEvo reconstructs a reassemblable representation, proposes low-level edits with a long-horizon agent, rebuilds an ABI-preserving optimized object, and accepts candidates only after differential verification against K0 under identical launches. AsmEvo combines code-object recovery, metadata-aware rebuilding, profiling-guided hot-window editing, correctness-gated timing, and conservative in-place patch fallback. We conduct extensive experiments with AsmEvo on various AMD GPU kernels. On MI308X, AsmEvo improves 29 of 30 selected KernelBench kernels, reaching 1.35x geometric-mean and 3.88x maximum speedup. On MI300X production workloads, it improves all evaluated AITer binaries and vLLM/SGLang Triton assembly kernels, reaching 1.09x/1.31x and 1.18x/1.34x geometric-mean/maximum speedups, respectively, while preserving functional equivalence.

cs.CL↗
arXiv2026

Mining beyond Earth with Space Robots: Exploration, Sampling, and Extraction

Space resource acquisition and utilization, commonly referred to as Space Mining, represent critical pathways for enabling sustained human exploration and unlocking commercial opportunities in space. These resources mainly include helium-3, water, mineral resources on the Moon and Mars, and abundant mineral deposits on asteroids. Due to the harsh conditions of space, communication delays, and high launch costs, the development of autonomous robotic systems is critical to achieving efficient, cost-effective space mining. This paper provides a comprehensive overview of space mining robotics and associated technologies. First, we review the background of space mining, including international policies, commercial entities, and recent advancements. We define a systematic six-stage architecture for space mining: Exploration is initiated by (1) remote sensing for target identification and (2) precise in situ robotic detection; Sampling progresses from (3) single-robot small-scale sampling to (4) multi-robot large-scale excavation; and Extraction integrates (5) autonomous resource extraction and (6) final integration into in situ construction or terrestrial transport. Additionally, we review and curate existing resources for space mining research, including real-world mission data, terrestrial analog datasets, and high-fidelity simulation environments. Finally, we identify critical open challenges in autonomous space mining and delineate a strategic research roadmap to bridge current technological gaps, fostering the transition toward a sustainable off-world economy. To track ongoing developments in space mining, we maintain an updated project page: https://github.com/OpenSpace-Lab/Space-Mining-with-Robotics-List.

cs.RO↗
arXiv2026

$\tau_0$-VLA: a Hierarchical Robot Foundation Model with World-Model-Guided Test-Time Computation

Long-horizon robot manipulation requires a robot to both execute individual skills reliably and sequence them coherently over extended tasks. Most hierarchical vision-language-action (VLA) models make each such decision with a single forward pass, leaving no mechanism to allocate additional computation to difficult or consequential choices. We introduce $\tau_0$-VLA, a hierarchical robot foundation model that formulates high-level subtask generation as a compute-scalable inference problem through world-model-guided test-time computation. At each inference step, the high-level policy uses execution memory to generate a subtask and, when needed, searches over alternatives before committing to its output. A low-level policy then executes the generated subtask across multiple robot embodiments. The policy is trained on 40,115 hours of heterogeneous real-world data with multimodal co-training. Across in-domain and distribution-shifted settings, allocating additional test-time computation substantially improves next-subtask prediction accuracy, and these gains translate into higher closed-loop success on long-horizon robot manipulation tasks.

cs.RO↗
arXiv2026

MemChain: Learning Interpretable Memory Traces for Memory-Augmented LLM Agents

Memory-augmented LLM agents typically answer queries by retrieving relevant memories and feeding them directly to an answer model. This retrieval-as-evidence paradigm assumes retrieved memories are already suitable for reasoning, leaving the answer model to resolve redundancy, conflicts, and weak relevance while incurring substantial context overhead in long-term memory tasks. We propose MemChain, a trainable post-retrieval memory policy that transforms retrieved candidates into answer-facing active memory, represented as a compact and grounded evidence context. Given a user query and retrieved candidates, MemChain first generates a question-conditioned evidence plan, then constructs an ordered grounded evidence trace that organizes retrieved memories according to their semantic roles and dependencies, and finally executes explicit memory actions to produce a concise evidence context for answer generation. To train the mediator, we introduce a two-stage learning framework. Supervised trace learning first teaches the policy to generate structurally valid plans, traces, actions, and evidence contexts. We then propose Trace-Guided Memory Policy Optimization (TMPO), a reinforcement learning objective that optimizes the memory policy using downstream answer quality while jointly encouraging trace grounding, evidence support, structural validity, and answer stability across multiple rollouts. Experiments on LoCoMo and LongMemEval-S demonstrate that MemChain consistently achieves state-of-the-art performance across both closed-source and open-weight frozen answer models while substantially reducing the memory context passed to the answer model.

cs.AI↗
arXiv2026

Bayesian Repetition Penalty: A Principled Adjacent-Conditional Framework for Reversing Attention Collapse in Autoregressive Language Models

Attention collapse in autoregressive language models -- manifested as repetitive token loops where the model becomes trapped in self-reinforcing attractors -- is a persistent pathology that existing decoding-time heuristics fail to address at its root cause. We present a principled framework that penalises or compensates anomalous confidence arising from collapsed generation patterns, by comparing a token's observed frequency against its corpus prior through an adjacent-conditional probability construction. The resulting self-normalising penalty ratio $R=f(m,n,p)/f(np,n,p)$ requires no ad hoc standardisation and admits a closed-form logit offset with zero approximation error. The correction is isolated from the loss gradient and accumulated into a frozen output-layer bias via exponential moving average, enabling deployment as a repair mechanism for models that have already collapsed without requiring intrusive modifications to standard training pipelines. Experimental validation on a 1.5B-parameter model demonstrates that the frozen-bias mechanism can rescue a model already trapped in a collapsed attractor, reducing 2-gram repetition from 0.073 to near 0 while preserving generation quality.

cs.AI↗
arXiv2026

Towards Precision Therapy in Hepatocellular Carcinoma: A Clinical-Reasoning LLM for Risk Stratification and Treatment Guidance

Hepatocellular carcinoma (HCC) is a common malignancy and a leading cause of cancer-related mortality. Current guidelines and staging systems provide coarse categories, but often miss within-stage heterogeneity and the clinical context in electronic medical records (EMRs). We present HCC-STAR (Hepatocellular Carcinoma Staging, Treatment And pRognosis), a clinically aligned large language model that reads routine EMR narratives and jointly outputs risk score-based staging, ranked guideline-consistent treatments with evidence-based rationales, and individualized survival estimates. We curated about 30,000 HCC cases from SEER and expanded them into EMR-style narrative training data using a clinician-validated, prompt-based augmentation workflow. On this corpus, we developed a knowledge-aligned reasoning framework optimized with a step-verifiable composite reward, moving beyond text-level memorization of clinical guidelines. In a multi-center cohort of 6,668 patients from 12 hospitals in China, HCC-STAR achieved state-of-the-art performance in treatment recommendation and risk stratification compared with clinical guidelines and competitive models, including GPT-5 and Gemini-2.5 Pro. Hypothetical overall-survival analysis showed a median survival of 51 months under adherence to HCC-STAR recommendations, compared with 29 and 32 months under BCLC and CNLC. In clinician-centric evaluations, blinded hepatobiliary specialists rated HCC-STAR's reasoning and evidence-based justifications as trustworthy. The model surpassed resident and attending physicians in treatment accuracy and helped physicians make more accurate decisions faster when used as an assistant. These findings support HCC-STAR as a reliable and verifiable decision-support system for risk stratification and precision therapy in HCC.

cs.AI↗
arXiv2026

Double-periodic pulsations simultaneously detected in mid-infrared and hard X-ray emissions during an X1.5 flare

Quasi-periodic pulsations (QPPs) have been observed in a broad electromagnetic spectrum, encompassing radio, ultraviolet, white light, X-rays, and Gama-rays. Yet, flare-associated QPPs remain rarely detected in mid-infrared emission. Here, we explored dual-period QPPs in the mid-infrared waveband, hard X-rays (HXRs), and microwave emission during an X1.5 flare on 2024 December 30 (SOL2024-12-30T04:01). Flare QPPs with dual quasi-periods at about 8.5 s and 4.6 s were simultaneously detected in the AIMS 8-10 um, Fermi 26-50 keV, and HXI 20-50 keV wavebands during the impulsive phase. Imaging observations show that the flare emission sources in the mid-infrared, HXR, and white-light wavebands are spatially coincident. Mid-infrared emissions are primarily localized at the loop top and double footpoints, which are connected by a hot plasma loop. These observational features support intermittent and rapid energy release via oscillatory magnetic reconnection during the solar flare. Differential emission measure analysis confirms fast sausage waves in flaring loops, while the WST observation indicates a white-light flare. We localized the flare QPPs with double periods in mid-infrared, HXR, and microwave emissions during a white-light flare. The flare-associated QPPs may be attributed to a quasi-periodic regime of magnetic reconnection, with the double periods likely modulated by quasi-harmonics of sausage waves.

astro-ph.SR↗
arXiv2026

UCOB: Learning to Utilize and Evolve Agentic Skills via Credit-Aware On-Policy Bidirectional Self-Distillation

Skill memories can improve agentic reinforcement learning by reusing past experience as textual guidance, but retrieved skills are not oracular: they may help in one state while misleading the same policy in another. This makes the common privileged-teacher assumption fragile, namely that a skill-conditioned prompt can be treated as a fixed teacher for the no-skill prompt. We introduce UCOB, a framework for learning to utilize and evolve agentic skills via credit-aware on-policy bidirectional self-distillation. UCOB treats skill-conditioned and no-skill prompts as two on-policy context views of the same model, compares their return-to-go within the same task and anchor state, and uses the higher-return view as the local teacher. This local credit signal internalizes useful skill-conditioned behavior, corrects misleading skill usage, and guides task/state skill memory updates, utility-aware retrieval, and reflection self-training. Experiments on agentic tasks, including ALFWorld, WebShop, and Search-QA, show that UCOB outperforms skill-free RL, skill-memory baselines, and self-distillation methods across model scales, with up to 23.5 and 18.0 point gains over SOTA baselines on ALFWorld and WebShop. Ablations and analyses further validate its core mechanisms, continual adaptation across environments, and modest training overhead. Code is available at https://github.com/TU2021/UCOB.

cs.AI↗
arXiv2026

He3-Seeker: Robotic Information Planning for Lunar Helium-3 Distribution Mapping

Lunar helium-3 is a highly valuable strategic resource, pivotal to the advancement of both deep-space exploration and space mining. Existing lunar helium-3 exploration methodologies rely primarily on indirect measurements via remote sensing, which are often characterized by limited precision, low reliability, and insufficient spatial resolution. In this paper, we introduce He3-Seeker, an active robotic exploration method for helium-3 distribution mapping. First, we provide a formal definition of the active helium-3 exploration problem. Subsequently, we developed the He3-Seeker framework, which is conceptually based on multi-point drilling, sampling, and in situ analysis. In particular, we use robotic information planning (RIP) to guide autonomous robot navigation and active sensing. Additionally, to thoroughly evaluate the proposed algorithm, we introduce a reliable method for generating reference data of lunar helium-3 distribution based on low-resolution orbital remote sensing measurements. Simulation experiments verify that He3-Seeker achieves both rapid and high-fidelity mapping of helium-3 distribution, providing a reliable solution for resource exploration tasks. Our code and simulation environment will be publicly accessible at https://github.com/OpenSpace-Lab/He3-Seeker.

cs.RO↗
arXiv2026

SpikeVLA: Vision-Language-Action Models with Spiking Neural Networks

Vision-Language-Action (VLA) models have become a dominant paradigm for embodied intelligence. However, most existing approaches are built on large-scale transformers, resulting in substantial inference latency and energy consumption that limit their practical deployment in low-power, real-time scenarios. We propose SpikeVLA, a spiking VLA architecture for embodied navigation with energy-efficient inference, consisting of three key components. (i) A spiking vision encoder, Spike-V, that replaces dense continuous layers with event-driven spiking layers to reduce the energy consumption of visual representation learning. (ii) A multi-modal spiking large language model, Spike-L, that reformulates cross-modal reasoning with spiking dynamics and token-level event-driven sparsity to further lower computational cost. (iii) A spiking action policy network, Spike-A employs Laplacian-kernel population coding with a multi-layer fully connected SNN, and decodes spiking activities into stable and robust continuous control with energy-efficient inference under low-power constraints. Experiments on navigation and robotic control tasks show that SpikeVLA significantly reduces energy consumption and computational cost while maintaining competitive performance, highlighting its potential for low-power, real-time embodied intelligence.

cs.RO↗