OpenRaiser/Intern-Atlas huggingface dataset:
AdaptMol: Adaptive Fusion from Sequence String to Topological Structure for Few-shot Drug Discovery
Venue: arXiv cs.LG 2025
Year: 2025

Accurate molecular property prediction (MPP) is a critical step in modern drug development. However, the scarcity of experimental validation data poses a significant challenge to AI-driven research paradigms. Under few-shot learning scenarios, the quality of molecular representations directly dictates the theoretical upper limit of model performance. We present AdaptMol, a prototypical network integrating Adaptive multimodal fusion for Molecular representation. This framework employs a dual-level attention mechanism to dynamically integrate global and local molecular features derived from two modalities: SMILES sequences and molecular graphs. (1) At the local level, structural features such as atomic interactions and substructures are extracted from molecular graphs, emphasizing fine-grained topological information; (2) At the global level, the SMILES sequence provides a holistic representation of the molecule. To validate the necessity of multimodal adaptive fusion, we propose an interpretable approach based on identifying molecular active substructures to demonstrate that multimodal adaptive fusion can efficiently represent molecules. Extensive experiments on three commonly used benchmarks under 5-shot and 10-shot settings demonstrate that AdaptMol achieves state-of-the-art performance in most cases. The rationale-extracted method guides the fusion of two modalities and highlights the importance of both modalities.
AES-RV: Hardware-Efficient RISC-V Accelerator with Low-Latency AES Instruction Extension for IoT Security
Venue: arXiv cs.AR 2025
Year: 2025

The Advanced Encryption Standard (AES) is a widely adopted cryptographic algorithm essential for securing embedded systems and IoT platforms. However, existing AES hardware accelerators often face limitations in performance, energy efficiency, and flexibility. This paper presents AES-RV, a hardware-efficient RISC-V accelerator featuring low-latency AES instruction extensions optimized for real-time processing across all AES modes and key sizes. AES-RV integrates three key innovations: high-bandwidth internal buffers for continuous data processing, a specialized AES unit with custom low-latency instructions, and a pipelined system supported by a ping-pong memory transfer mechanism. Implemented on the Xilinx ZCU102 SoC FPGA, AES-RV achieves up to 255.97 times speedup and up to 453.04 times higher energy efficiency compared to baseline and conventional CPU/GPU platforms. It also demonstrates superior throughput and area efficiency against state-of-the-art AES accelerators, making it a strong candidate for secure and high-performance embedded systems.
K*-Means: A Parameter-free Clustering Algorithm
Venue: arXiv cs.LG 2025
Year: 2025

Clustering is a widely used and powerful machine learning technique, but its effectiveness is often limited by the need to specify the number of clusters, k, or by relying on thresholds that implicitly determine k. We introduce k*-means, a novel clustering algorithm that eliminates the need to set k or any other parameters. Instead, it uses the minimum description length principle to automatically determine the optimal number of clusters, k*, by splitting and merging clusters while also optimising the standard k-means objective. We prove that k*-means is guaranteed to converge and demonstrate experimentally that it significantly outperforms existing methods in scenarios where k is unknown. We also show that it is accurate in estimating k, and that empirically its runtime is competitive with existing methods, and scales well with dataset size.
GTR: Gaussian Splatting Tracking and Reconstruction of Unknown Objects Based on Appearance and Geometric Complexity
Venue: arXiv cs.CV 2025
Year: 2025

We present a novel method for 6-DoF object tracking and high-quality 3D reconstruction from monocular RGBD video. Existing methods, while achieving impressive results, often struggle with complex objects, particularly those exhibiting symmetry, intricate geometry or complex appearance. To bridge these gaps, we introduce an adaptive method that combines 3D Gaussian Splatting, hybrid geometry/appearance tracking, and key frame selection to achieve robust tracking and accurate reconstructions across a diverse range of objects. Additionally, we present a benchmark covering these challenging object classes, providing high-quality annotations for evaluating both tracking and reconstruction performance. Our approach demonstrates strong capabilities in recovering high-fidelity object meshes, setting a new standard for single-sensor 3D reconstruction in open-world environments.
LifelongAgentBench: Evaluating LLM Agents as Lifelong Learners
Venue: arXiv cs.AI 2025
Year: 2025

Lifelong learning is essential for intelligent agents operating in dynamic environments. Current large language model (LLM)-based agents, however, remain stateless and unable to accumulate or transfer knowledge over time. Existing benchmarks treat agents as static systems and fail to evaluate lifelong learning capabilities. We present LifelongAgentBench, the first unified benchmark designed to systematically assess the lifelong learning ability of LLM agents. It provides skill-grounded, interdependent tasks across three interactive environments, Database, Operating System, and Knowledge Graph, with automatic label verification, reproducibility, and modular extensibility. Extensive experiments reveal that conventional experience replay has limited effectiveness for LLM agents due to irrelevant information and context length constraints. We further introduce a group self-consistency mechanism that significantly improves lifelong learning performance. We hope LifelongAgentBench will advance the development of adaptive, memory-capable LLM agents.
Basic model for ranking microfinance institutions
Venue: arXiv cs.IR 2025
Year: 2025

This paper discusses the challenges encountered in building a ranking model for aggregator site products, using the example of ranking microfinance institutions (MFIs) based on post-click conversion. We suggest which features of MFIs should be considered, and using an algorithm based on Markov chains, we demonstrate the ``usefulness'' of these features on real data. The ideas developed in this work can be applied to aggregator websites in microinsurance, especially when personal data is unavailable. Since we did not find similar datasets in the public domain, we are publishing our dataset with a detailed description of its attributes.
Accelerating Neural Network Training Along Sharp and Flat Directions
Venue: arXiv cs.LG 2025
Year: 2025

Recent work has highlighted a surprising alignment between gradients and the top eigenspace of the Hessian -- termed the Dominant subspace -- during neural network training. Concurrently, there has been growing interest in the distinct roles of sharp and flat directions in the Hessian spectrum. In this work, we study Bulk-SGD, a variant of SGD that restricts updates to the orthogonal complement of the Dominant subspace. Through ablation studies, we characterize the stability properties of Bulk-SGD and identify critical hyperparameters that govern its behavior. We show that updates along the Bulk subspace, corresponding to flatter directions in the loss landscape, can accelerate convergence but may compromise stability. To balance these effects, we introduce interpolated gradient methods that unify SGD, Dom-SGD, and Bulk-SGD. Finally, we empirically connect this subspace decomposition to the Generalized Gauss-Newton and Functional Hessian terms, showing that curvature energy is largely concentrated in the Dominant subspace. Our findings suggest a principled approach to designing curvature-aware optimizers.
Unveiling Knowledge Utilization Mechanisms in LLM-based Retrieval-Augmented Generation
Venue: arXiv cs.CL 2025
Year: 2025

Considering the inherent limitations of parametric knowledge in large language models (LLMs), retrieval-augmented generation (RAG) is widely employed to expand their knowledge scope. Since RAG has shown promise in knowledge-intensive tasks like open-domain question answering, its broader application to complex tasks and intelligent assistants has further advanced its utility. Despite this progress, the underlying knowledge utilization mechanisms of LLM-based RAG remain underexplored. In this paper, we present a systematic investigation of the intrinsic mechanisms by which LLMs integrate internal (parametric) and external (retrieved) knowledge in RAG scenarios. Specially, we employ knowledge stream analysis at the macroscopic level, and investigate the function of individual modules at the microscopic level. Drawing on knowledge streaming analyses, we decompose the knowledge utilization process into four distinct stages within LLM layers: knowledge refinement, knowledge elicitation, knowledge expression, and knowledge contestation. We further demonstrate that the relevance of passages guides the streaming of knowledge through these stages. At the module level, we introduce a new method, knowledge activation probability entropy (KAPE) for neuron identification associated with either internal or external knowledge. By selectively deactivating these neurons, we achieve targeted shifts in the LLM's reliance on one knowledge source over the other. Moreover, we discern complementary roles for multi-head attention and multi-layer perceptron layers during knowledge formation. These insights offer a foundation for improving interpretability and reliability in retrieval-augmented LLMs, paving the way for more robust and transparent generative solutions in knowledge-intensive domains.
To Recommend or Not to Recommend: Designing and Evaluating AI-Enabled Decision Support for Time-Critical Medical Events
Venue: arXiv cs.HC 2025
Year: 2025

AI-enabled decision-support systems aim to help medical providers rapidly make decisions with limited information during medical emergencies. A critical challenge in developing these systems is supporting providers in interpreting the system output to make optimal treatment decisions. In this study, we designed and evaluated an AI-enabled decision-support system to aid providers in treating patients with traumatic injuries. We first conducted user research with physicians to identify and design information types and AI outputs for a decision-support display. We then conducted an online experiment with 35 medical providers from six health systems to evaluate two human-AI interaction strategies: (1) AI information synthesis and (2) AI information and recommendations. We found that providers were more likely to make correct decisions when AI information and recommendations were provided compared to receiving no AI support. We also identified two socio-technical barriers to providing AI recommendations during time-critical medical events: (1) an accuracy-time trade-off in providing recommendations and (2) polarizing perceptions of recommendations between providers. We discuss three implications for developing AI-enabled decision support used in time-critical events, contributing to the limited research on human-AI interaction in this context.
SOCIA-$\nabla$: Textual Gradient Meets Multi-Agent Orchestration for Automated Simulator Generation
Venue: arXiv cs.AI 2025
Year: 2025

In this paper, we present SOCIA-$\nabla$, an end-to-end, agentic framework that treats simulator construction asinstance optimization over code within a textual computation graph. Specialized LLM-driven agents are embedded as graph nodes, and a workflow manager executes a loss-driven loop: code synthesis -> execution -> evaluation -> code repair. The optimizer performs Textual-Gradient Descent (TGD), while human-in-the-loop interaction is reserved for task-spec confirmation, minimizing expert effort and keeping the code itself as the trainable object. Across three CPS tasks, i.e., User Modeling, Mask Adoption, and Personal Mobility, SOCIA-$\nabla$ attains state-of-the-art overall accuracy. By unifying multi-agent orchestration with a loss-aligned optimization view, SOCIA-$\nabla$ converts brittle prompt pipelines into reproducible, constraint-aware simulator code generation that scales across domains and simulation granularities. We will release the code soon.
Incentivize Contribution and Learn Parameters Too: Federated Learning with Strategic Data Owners
Venue: arXiv cs.GT 2025
Year: 2025

Classical federated learning (FL) assumes that the clients have a limited amount of noisy data with which they voluntarily participate and contribute towards learning a global, more accurate model in a principled manner. The learning happens in a distributed fashion without sharing the data with the center. However, these methods do not consider the incentive of an agent for participating and contributing to the process, given that data collection and running a distributed algorithm is costly for the clients. The question of rationality of contribution has been asked recently in the literature and some results exist that consider this problem. This paper addresses the question of simultaneous parameter learning and incentivizing contribution in a truthful manner, which distinguishes it from the extant literature. Our first mechanism incentivizes each client to contribute to the FL process at a Nash equilibrium and simultaneously learn the model parameters. We also ensure that agents are incentivized to truthfully reveal information in the intermediate stages of the algorithm. However, this equilibrium outcome can be away from the optimal, where clients contribute with their full data and the algorithm learns the optimal parameters. We propose a second mechanism that enables the full data contribution along with optimal parameter learning. Large scale experiments with real (federated) datasets (CIFAR-10, FEMNIST, and Twitter) show that these algorithms converge quite fast in practice, yield good welfare guarantees and better model performance for all agents.
FL-PLAS: Federated Learning with Partial Layer Aggregation for Backdoor Defense Against High-Ratio Malicious Clients
Venue: arXiv cs.CR 2025
Year: 2025

Federated learning (FL) is gaining increasing attention as an emerging collaborative machine learning approach, particularly in the context of large-scale computing and data systems. However, the fundamental algorithm of FL, Federated Averaging (FedAvg), is susceptible to backdoor attacks. Although researchers have proposed numerous defense algorithms, two significant challenges remain. The attack is becoming more stealthy and harder to detect, and current defense methods are unable to handle 50\% or more malicious users or assume an auxiliary server dataset. To address these challenges, we propose a novel defense algorithm, FL-PLAS, \textbf{F}ederated \textbf{L}earning based on \textbf{P}artial\textbf{ L}ayer \textbf{A}ggregation \textbf{S}trategy. In particular, we divide the local model into a feature extractor and a classifier. In each iteration, the clients only upload the parameters of a feature extractor after local training. The server then aggregates these local parameters and returns the results to the clients. Each client retains its own classifier layer, ensuring that the backdoor labels do not impact other clients. We assess the effectiveness of FL-PLAS against state-of-the-art (SOTA) backdoor attacks on three image datasets and compare our approach to six defense strategies. The results of the experiment demonstrate that our methods can effectively protect local models from backdoor attacks. Without requiring any auxiliary dataset for the server, our method achieves a high main-task accuracy with a lower backdoor accuracy even under the condition of 90\% malicious users with the attacks of trigger, semantic and edge-case.
Synapse: Virtualizing Match Tables in Programmable Hardware
Venue: arXiv cs.AR 2025
Year: 2025

Efficient network packet processing increasingly demands dynamic, adaptive, and run-time resizable match table allocation to handle the diverse and heterogeneous nature of traffic patterns and rule sets. Achieving this flexibility at high performance in hardware is challenging, as fixed resource constraints and architectural limitations have traditionally restricted such adaptability. In this paper, we introduce Synapse, an extension to programmable data plane architectures that incorporates the Virtual Matching Table (VMT) framework, drawing inspiration from virtual memory systems in Operating Systems (OSs), but specifically tailored to network processing. This abstraction layer allows logical tables to be elastic, enabling dynamic and efficient match table allocation at runtime. Our design features a hybrid memory system, leveraging on-chip associative memories for fast matching of the most popular rules and off-chip addressable memory for scalable and cost-effective storage. Furthermore, by employing a sharding mechanism across physical match tables, Synapse ensures that the power required per key match remains bounded and proportional to the key distribution and the size of the involved shard. To address the challenge of dynamic allocation, we formulate and solve an optimization problem that dynamically allocates physical match tables to logical tables based on pipeline usage and traffic characteristics at the millisecond scale. We prototype our design on FPGA and develop a simulator to evaluate the performance, demonstrating its effectiveness and scalability.
Unsupervised Port Berth Identification from Automatic Identification System Data
Venue: arXiv cs.LG 2025
Year: 2025

Port berthing sites are regions of high interest for monitoring and optimizing port operations. Data sourced from the Automatic Identification System (AIS) can be superimposed on berths enabling their real-time monitoring and revealing long-term utilization patterns. Ultimately, insights from multiple berths can uncover bottlenecks, and lead to the optimization of the underlying supply chain of the port and beyond. However, publicly available documentation of port berths, even when available, is frequently incomplete - e.g. there may be missing berths or inaccuracies such as incorrect boundary boxes - necessitating a more robust, data-driven approach to port berth localization. In this context, we propose an unsupervised spatial modeling method that leverages AIS data clustering and hyperparameter optimization to identify berthing sites. Trained on one month of freely available AIS data and evaluated across ports of varying sizes, our models significantly outperform competing methods, achieving a mean Bhattacharyya distance of 0.85 when comparing Gaussian Mixture Models (GMMs) trained on separate data splits, compared to 13.56 for the best existing method. Qualitative comparison with satellite images and existing berth labels further supports the superiority of our method, revealing more precise berth boundaries and improved spatial resolution across diverse port environments.
Enhanced Multimodal Hate Video Detection via Channel-wise and Modality-wise Fusion
Venue: arXiv cs.MM 2025
Year: 2025

The rapid rise of video content on platforms such as TikTok and YouTube has transformed information dissemination, but it has also facilitated the spread of harmful content, particularly hate videos. Despite significant efforts to combat hate speech, detecting these videos remains challenging due to their often implicit nature. Current detection methods primarily rely on unimodal approaches, which inadequately capture the complementary features across different modalities. While multimodal techniques offer a broader perspective, many fail to effectively integrate temporal dynamics and modality-wise interactions essential for identifying nuanced hate content. In this paper, we present CMFusion, an enhanced multimodal hate video detection model utilizing a novel Channel-wise and Modality-wise Fusion Mechanism. CMFusion first extracts features from text, audio, and video modalities using pre-trained models and then incorporates a temporal cross-attention mechanism to capture dependencies between video and audio streams. The learned features are then processed by channel-wise and modality-wise fusion modules to obtain informative representations of videos. Our extensive experiments on a real-world dataset demonstrate that CMFusion significantly outperforms five widely used baselines in terms of accuracy, precision, recall, and F1 score. Comprehensive ablation studies and parameter analyses further validate our design choices, highlighting the model's effectiveness in detecting hate videos. The source codes will be made publicly available at https://github.com/EvelynZ10/cmfusion.
CorBenchX: Large-Scale Chest X-Ray Error Dataset and Vision-Language Model Benchmark for Report Error Correction
Venue: arXiv cs.AI 2025
Year: 2025

AI-driven models have shown great promise in detecting errors in radiology reports, yet the field lacks a unified benchmark for rigorous evaluation of error detection and further correction. To address this gap, we introduce CorBenchX, a comprehensive suite for automated error detection and correction in chest X-ray reports, designed to advance AI-assisted quality control in clinical practice. We first synthesize a large-scale dataset of 26,326 chest X-ray error reports by injecting clinically common errors via prompting DeepSeek-R1, with each corrupted report paired with its original text, error type, and human-readable description. Leveraging this dataset, we benchmark both open- and closed-source vision-language models,(e.g., InternVL, Qwen-VL, GPT-4o, o4-mini, and Claude-3.7) for error detection and correction under zero-shot prompting. Among these models, o4-mini achieves the best performance, with 50.6 % detection accuracy and correction scores of BLEU 0.853, ROUGE 0.924, BERTScore 0.981, SembScore 0.865, and CheXbertF1 0.954, remaining below clinical-level accuracy, highlighting the challenge of precise report correction. To advance the state of the art, we propose a multi-step reinforcement learning (MSRL) framework that optimizes a multi-objective reward combining format compliance, error-type accuracy, and BLEU similarity. We apply MSRL to QwenVL2.5-7B, the top open-source model in our benchmark, achieving an improvement of 38.3% in single-error detection precision and 5.2% in single-error correction over the zero-shot baseline.
Tiny QA Benchmark++: Ultra-Lightweight, Synthetic Multilingual Dataset Generation & Smoke-Tests for Continuous LLM Evaluation
Venue: arXiv cs.AI 2025
Year: 2025

Tiny QA Benchmark++ (TQB++) presents an ultra-lightweight, multilingual smoke-test suite designed to give large-language-model (LLM) pipelines a unit-test style safety net dataset that runs in seconds with minimal cost. Born out of the tight feedback-loop demands building the Comet Opik prompt-optimization SDK, where waiting on heavyweight benchmarks breaks developer flow. TQB++ couples a 52-item English gold set (less than 20 kB) with a tiny synthetic-data generator pypi package built on provider-agnostic LiteLLM. The generator lets practitioners mint their own tiny packs in any language, domain, or difficulty, while ten ready-made packs already cover Arabic, Chinese, French, German, Japanese, Korean, Portuguese, Russian, Spanish, and Turkish. Every dataset ships with Croissant metadata and plug-and-play files for OpenAI-Evals, LangChain, and standard CI tools, so teams can drop deterministic micro-benchmarks directly into pull-request gates, prompt-engineering loops, and production dashboards without touching GPU budgets. A complete TQB++ run adds only a few seconds to pipeline latency yet reliably flags prompt-template errors, tokenizer drift, and fine-tuning side-effects long before full-scale suites like MMLU or BIG-Bench would finish configuring. The entire framework is released to accelerate continuous, resource-efficient quality assurance across the generative-AI ecosystem.