arXiv subjects

Ming Hu

Publications and source records attributed to Ming Hu.

At least 73 records · Page 4Linked to original sources

arXiv2025

Accelerating Discovery of Extreme Lattice Thermal Conductivity by Crystal Attention Graph Neural Network (CATGNN) Using Chemical Bonding Intuitive Descriptors

Designing materials with targeted lattice thermal conductivity (LTC) demands electronic-level insight into chemical bonding. We introduce two bonding descriptors, namely normalized negative integrated crystal orbital Hamilton populations (-ICOHP) and normalized integrated crystal orbital bond index (ICOBI), that strongly correlate with LTC and rattling (mean-squared displacement), surpassing empirical rules and the unnormalized -ICOHP across >4,500 inorganic crystals by first-principles. We train a Crystal Attention Graph Neural Network (CATGNN) to predict these descriptors and screen ~200,000 database structures for extreme LTCs. From 367 (533) candidates with low (high) normalized -ICOHP and normalized ICOBI, first-principles validation identifies 106 dynamically stable compounds with LTC <5 W/mK (68% <2 W/mK) and 13 stable compounds with LTC >100 W/mK. The descriptors' low cost and clear physical meaning provide a rapid, reliable route to high-throughput discovery and inverse design of crystalline materials with ultralow or ultrahigh LTC for applications in thermal insulation, thermoelectrics, and electronics cooling.

cond-mat.mtrl-sci↗

arXiv2025

LLMs4All: A Review of Large Language Models Across Academic Disciplines

Cutting-edge Artificial Intelligence (AI) techniques keep reshaping our view of the world. For example, Large Language Models (LLMs) based applications such as ChatGPT have shown the capability of generating human-like conversation on extensive topics. Due to the impressive performance on a variety of language-related tasks (e.g., open-domain question answering, translation, and document summarization), one can envision the far-reaching impacts that can be brought by the LLMs with broader real-world applications (e.g., customer service, education and accessibility, and scientific discovery). Inspired by their success, this paper will offer an overview of state-of-the-art LLMs and their integration into a wide range of academic disciplines, including: (1) arts, letters, and law (e.g., history, philosophy, political science, arts and architecture, law), (2) economics and business (e.g., finance, economics, accounting, marketing), and (3) science and engineering (e.g., mathematics, physics and mechanical engineering, chemistry and chemical engineering, life sciences and bioengineering, earth sciences and civil engineering, computer science and electrical engineering). Integrating humanity and technology, in this paper, we will explore how LLMs are shaping research and practice in these fields, while also discussing key limitations, open challenges, and future directions in the era of generative AI. The review of how LLMs are engaged across disciplines-along with key observations and insights-can help researchers and practitioners interested in exploiting LLMs to advance their works in diverse real-world applications.

cs.CL↗

arXiv2025

Shedding Light on VLN Robustness: A Black-box Framework for Indoor Lighting-based Adversarial Attack

Vision-and-Language Navigation (VLN) agents have made remarkable progress, but their robustness remains insufficiently studied. Existing adversarial evaluations often rely on perturbations that manifest as unusual textures rarely encountered in everyday indoor environments. Errors under such contrived conditions have limited practical relevance, as real-world agents are unlikely to encounter such artificial patterns. In this work, we focus on indoor lighting, an intrinsic yet largely overlooked scene attribute that strongly influences navigation. We propose Indoor Lighting-based Adversarial Attack (ILA), a black-box framework that manipulates global illumination to disrupt VLN agents. Motivated by typical household lighting usage, we design two attack modes: Static Indoor Lighting-based Attack (SILA), where the lighting intensity remains constant throughout an episode, and Dynamic Indoor Lighting-based Attack (DILA), where lights are switched on or off at critical moments to induce abrupt illumination changes. We evaluate ILA on two state-of-the-art VLN models across three navigation tasks. Results show that ILA significantly increases failure rates while reducing trajectory efficiency, revealing previously unrecognized vulnerabilities of VLN agents to realistic indoor lighting variations.

cs.CV↗

arXiv2025

ClaimGen-CN: A Large-scale Chinese Dataset for Legal Claim Generation

Legal claims refer to the plaintiff's demands in a case and are essential to guiding judicial reasoning and case resolution. While many works have focused on improving the efficiency of legal professionals, the research on helping non-professionals (e.g., plaintiffs) remains unexplored. This paper explores the problem of legal claim generation based on the given case's facts. First, we construct ClaimGen-CN, the first dataset for Chinese legal claim generation task, from various real-world legal disputes. Additionally, we design an evaluation metric tailored for assessing the generated claims, which encompasses two essential dimensions: factuality and clarity. Building on this, we conduct a comprehensive zero-shot evaluation of state-of-the-art general and legal-domain large language models. Our findings highlight the limitations of the current models in factual precision and expressive clarity, pointing to the need for more targeted development in this domain. To encourage further exploration of this important task, we will make the dataset publicly available.

cs.CL↗

arXiv2025

From AI for Science to Agentic Science: A Survey on Autonomous Scientific Discovery

Artificial intelligence (AI) is reshaping scientific discovery, evolving from specialized computational tools into autonomous research partners. We position Agentic Science as a pivotal stage within the broader AI for Science paradigm, where AI systems progress from partial assistance to full scientific agency. Enabled by large language models (LLMs), multimodal systems, and integrated research platforms, agentic AI shows capabilities in hypothesis generation, experimental design, execution, analysis, and iterative refinement -- behaviors once regarded as uniquely human. This survey provides a domain-oriented review of autonomous scientific discovery across life sciences, chemistry, materials science, and physics. We unify three previously fragmented perspectives -- process-oriented, autonomy-oriented, and mechanism-oriented -- through a comprehensive framework that connects foundational capabilities, core processes, and domain-specific realizations. Building on this framework, we (i) trace the evolution of AI for Science, (ii) identify five core capabilities underpinning scientific agency, (iii) model discovery as a dynamic four-stage workflow, (iv) review applications across the above domains, and (v) synthesize key challenges and future opportunities. This work establishes a domain-oriented synthesis of autonomous scientific discovery and positions Agentic Science as a structured paradigm for advancing AI-driven research.

cs.LG↗

arXiv2025

A Survey of Scientific Large Language Models: From Data Foundations to Agent Frontiers

Scientific Large Language Models (Sci-LLMs) are transforming how knowledge is represented, integrated, and applied in scientific research, yet their progress is shaped by the complex nature of scientific data. This survey presents a comprehensive, data-centric synthesis that reframes the development of Sci-LLMs as a co-evolution between models and their underlying data substrate. We formulate a unified taxonomy of scientific data and a hierarchical model of scientific knowledge, emphasizing the multimodal, cross-scale, and domain-specific challenges that differentiate scientific corpora from general natural language processing datasets. We systematically review recent Sci-LLMs, from general-purpose foundations to specialized models across diverse scientific disciplines, alongside an extensive analysis of over 270 pre-/post-training datasets, showing why Sci-LLMs pose distinct demands -- heterogeneous, multi-scale, uncertainty-laden corpora that require representations preserving domain invariance and enabling cross-modal reasoning. On evaluation, we examine over 190 benchmark datasets and trace a shift from static exams toward process- and discovery-oriented assessments with advanced evaluation protocols. These data-centric analyses highlight persistent issues in scientific data development and discuss emerging solutions involving semi-automated annotation pipelines and expert validation. Finally, we outline a paradigm shift toward closed-loop systems where autonomous agents based on Sci-LLMs actively experiment, validate, and contribute to a living, evolving knowledge base. Collectively, this work provides a roadmap for building trustworthy, continually evolving artificial intelligence (AI) systems that function as a true partner in accelerating scientific discovery.

cs.CL↗

arXiv2025

Lumina-DiMOO: An Omni Diffusion Large Language Model for Multi-Modal Generation and Understanding

We introduce Lumina-DiMOO, an open-source foundational model for seamless multi-modal generation and understanding. Lumina-DiMOO sets itself apart from prior unified models by utilizing a fully discrete diffusion modeling to handle inputs and outputs across various modalities. This innovative approach allows Lumina-DiMOO to achieve higher sampling efficiency compared to previous autoregressive (AR) or hybrid AR-Diffusion paradigms and adeptly support a broad spectrum of multi-modal tasks, including text-to-image generation, image-to-image generation (e.g., image editing, subject-driven generation, and image inpainting, etc.), as well as image understanding. Lumina-DiMOO achieves state-of-the-art performance on multiple benchmarks, surpassing existing open-source unified multi-modal models. To foster further advancements in multi-modal and discrete diffusion model research, we release our code and checkpoints to the community. Project Page: https://synbol.github.io/Lumina-DiMOO.

cs.CV↗

arXiv2025

MedQ-Bench: Evaluating and Exploring Medical Image Quality Assessment Abilities in MLLMs

Medical Image Quality Assessment (IQA) serves as the first-mile safety gate for clinical AI, yet existing approaches remain constrained by scalar, score-based metrics and fail to reflect the descriptive, human-like reasoning process central to expert evaluation. To address this gap, we introduce MedQ-Bench, a comprehensive benchmark that establishes a perception-reasoning paradigm for language-based evaluation of medical image quality with Multi-modal Large Language Models (MLLMs). MedQ-Bench defines two complementary tasks: (1) MedQ-Perception, which probes low-level perceptual capability via human-curated questions on fundamental visual attributes; and (2) MedQ-Reasoning, encompassing both no-reference and comparison reasoning tasks, aligning model evaluation with human-like reasoning on image quality. The benchmark spans five imaging modalities and over forty quality attributes, totaling 2,600 perceptual queries and 708 reasoning assessments, covering diverse image sources including authentic clinical acquisitions, images with simulated degradations via physics-based reconstructions, and AI-generated images. To evaluate reasoning ability, we propose a multi-dimensional judging protocol that assesses model outputs along four complementary axes. We further conduct rigorous human-AI alignment validation by comparing LLM-based judgement with radiologists. Our evaluation of 14 state-of-the-art MLLMs demonstrates that models exhibit preliminary but unstable perceptual and reasoning skills, with insufficient accuracy for reliable clinical use. These findings highlight the need for targeted optimization of MLLMs in medical IQA. We hope that MedQ-Bench will catalyze further exploration and unlock the untapped potential of MLLMs for medical image quality evaluation.

cs.CV↗

arXiv2025

Channel-Imposed Fusion: A Simple yet Effective Method for Medical Time Series Classification

The automatic classification of medical time series signals, such as electroencephalogram (EEG) and electrocardiogram (ECG), plays a pivotal role in clinical decision support and early detection of diseases. Although Transformer based models have achieved notable performance by implicitly modeling temporal dependencies through self-attention mechanisms, their inherently complex architectures and opaque reasoning processes undermine their trustworthiness in high stakes clinical settings. In response to these limitations, this study shifts focus toward a modeling paradigm that emphasizes structural transparency, aligning more closely with the intrinsic characteristics of medical data. We propose a novel method, Channel Imposed Fusion (CIF), which enhances the signal-to-noise ratio through cross-channel information fusion, effectively reduces redundancy, and improves classification performance. Furthermore, we integrate CIF with the Temporal Convolutional Network (TCN), known for its structural simplicity and controllable receptive field, to construct an efficient and explicit classification framework. Experimental results on multiple publicly available EEG and ECG datasets demonstrate that the proposed method not only outperforms existing state-of-the-art (SOTA) approaches in terms of various classification metrics, but also significantly enhances the transparency of the classification process, offering a novel perspective for medical time series classification.

cs.LG↗

arXiv2025

FilterFL: Knowledge Filtering-based Data-Free Backdoor Defense for Federated Learning

As a distributed machine learning paradigm, Federated Learning (FL) enables large-scale clients to collaboratively train a model without sharing their raw data. However, due to the lack of data auditing for untrusted clients, FL is vulnerable to poisoning attacks, especially backdoor attacks. By using poisoned data for local training or directly changing the model parameters, attackers can easily inject backdoors into the model, which can trigger the model to make misclassification of targeted patterns in images. To address these issues, we propose a novel data-free trigger-generation-based defense approach based on the two characteristics of backdoor attacks: i) triggers are learned faster than normal knowledge, and ii) trigger patterns have a greater effect on image classification than normal class patterns. Our approach generates the images with newly learned knowledge by identifying the differences between the old and new global models, and filters trigger images by evaluating the effect of these generated images. By using these trigger images, our approach eliminates poisoned models to ensure the updated global model is benign. Comprehensive experiments demonstrate that our approach can defend against almost all the existing types of backdoor attacks and outperform all the seven state-of-the-art defense methods with both IID and non-IID scenarios. Especially, our approach can successfully defend against the backdoor attack even when 80\% of the clients are malicious.

cs.LG↗

arXiv2025

A Comprehensive Assessment and Benchmark Study of Large Atomistic Foundation Models for Phonons

The rapid development of universal machine learning potentials (uMLPs) has enabled efficient, accurate predictions of diverse material properties across broad chemical spaces. While their capability for modeling phonon properties is emerging, systematic benchmarking across chemically diverse systems remains limited. We evaluate six recent uMLPs (EquiformerV2, MatterSim, MACE, and CHGNet) on 2,429 crystalline materials from the Open Quantum Materials Database. Models were used to compute atomic forces in displaced supercells, derive interatomic force constants (IFCs), and predict phonon properties including lattice thermal conductivity (LTC), compared with density functional theory (DFT) and experimental data. The EquiformerV2 pretrained model trained on the OMat24 dataset exhibits strong performance in predicting atomic forces and third-order IFC, while its fine-tuned counterpart consistently outperforms other models in predicting second-order IFC, LTC, and other phonon properties. Although MACE and CHGNet demonstrated comparable force prediction accuracy to EquiformerV2, notable discrepancies in IFC fitting led to poor LTC predictions. Conversely, MatterSim, despite lower force accuracy, achieved intermediate IFC predictions, suggesting error cancellation and complex relationships between force accuracy and phonon predictions. This benchmark guides the evaluation and selection of uMLPs for high-throughput screening of materials with targeted thermal transport properties.

cond-mat.mtrl-sci↗

arXiv2025

Requirements Development and Formalization for Reliable Code Generation: A Multi-Agent Vision

Automated code generation has long been considered the holy grail of software engineering. The emergence of Large Language Models (LLMs) has catalyzed a revolutionary breakthrough in this area. However, existing methods that only rely on LLMs remain inadequate in the quality of generated code, offering no guarantees of satisfying practical requirements. They lack a systematic strategy for requirements development and modeling. Recently, LLM-based agents typically possess powerful abilities and play an essential role in facilitating the alignment of LLM outputs with user requirements. In this paper, we envision the first multi-agent framework for reliable code generation based on \textsc{re}quirements \textsc{de}velopment and \textsc{fo}rmalization, named \textsc{ReDeFo}. This framework incorporates three agents, highlighting their augmentation with knowledge and techniques of formal methods, into the requirements-to-code generation pipeline to strengthen quality assurance. The core of \textsc{ReDeFo} is the use of formal specifications to bridge the gap between potentially ambiguous natural language requirements and precise executable code. \textsc{ReDeFo} enables rigorous reasoning about correctness, uncovering hidden bugs, and enforcing critical properties throughout the development process. In general, our framework aims to take a promising step toward realizing the long-standing vision of reliable, auto-generated software.

cs.SE↗

arXiv2025

Intern-S1: A Scientific Multimodal Foundation Model

In recent years, a plethora of open-source foundation models have emerged, achieving remarkable progress in some widely attended fields, with performance being quite close to that of closed-source models. However, in high-value but more challenging scientific professional fields, either the fields still rely on expert models, or the progress of general foundation models lags significantly compared to those in popular areas, far from sufficient for transforming scientific research and leaving substantial gap between open-source models and closed-source models in these scientific domains. To mitigate this gap and explore a step further toward Artificial General Intelligence (AGI), we introduce Intern-S1, a specialized generalist equipped with general understanding and reasoning capabilities with expertise to analyze multiple science modal data. Intern-S1 is a multimodal Mixture-of-Experts (MoE) model with 28 billion activated parameters and 241 billion total parameters, continually pre-trained on 5T tokens, including over 2.5T tokens from scientific domains. In the post-training stage, Intern-S1 undergoes offline and then online reinforcement learning (RL) in InternBootCamp, where we propose Mixture-of-Rewards (MoR) to synergize the RL training on more than 1000 tasks simultaneously. Through integrated innovations in algorithms, data, and training systems, Intern-S1 achieved top-tier performance in online RL training. On comprehensive evaluation benchmarks, Intern-S1 demonstrates competitive performance on general reasoning tasks among open-source models and significantly outperforms open-source models in scientific domains, surpassing closed-source state-of-the-art models in professional tasks, such as molecular synthesis planning, reaction condition prediction, predicting thermodynamic stabilities for crystals. Our models are available at https://huggingface.co/internlm/Intern-S1.

cs.LG↗

arXiv2025

S2-UniSeg: Fast Universal Agglomerative Pooling for Scalable Segment Anything without Supervision

Recent self-supervised image segmentation models have achieved promising performance on semantic segmentation and class-agnostic instance segmentation. However, their pretraining schedule is multi-stage, requiring a time-consuming pseudo-masks generation process between each training epoch. This time-consuming offline process not only makes it difficult to scale with training dataset size, but also leads to sub-optimal solutions due to its discontinuous optimization routine. To solve these, we first present a novel pseudo-mask algorithm, Fast Universal Agglomerative Pooling (UniAP). Each layer of UniAP can identify groups of similar nodes in parallel, allowing to generate both semantic-level and instance-level and multi-granular pseudo-masks within ens of milliseconds for one image. Based on the fast UniAP, we propose the Scalable Self-Supervised Universal Segmentation (S2-UniSeg), which employs a student and a momentum teacher for continuous pretraining. A novel segmentation-oriented pretext task, Query-wise Self-Distillation (QuerySD), is proposed to pretrain S2-UniSeg to learn the local-to-global correspondences. Under the same setting, S2-UniSeg outperforms the SOTA UnSAM model, achieving notable improvements of AP+6.9 on COCO, AR+11.1 on UVO, PixelAcc+4.5 on COCOStuff-27, RQ+8.0 on Cityscapes. After scaling up to a larger 2M-image subset of SA-1B, S2-UniSeg further achieves performance gains on all four benchmarks. Our code and pretrained models are available at https://github.com/bio-mlhui/S2-UniSeg

cs.CV↗

arXiv2025

DySTop

Federated Learning (FL) has emerged as a potential distributed learning paradigm that enables model training on edge devices (i.e., workers) while preserving data privacy. However, its reliance on a centralized server leads to limited scalability. Decentralized federated learning (DFL) eliminates the dependency on a centralized server by enabling peer-to-peer model exchange. Existing DFL mechanisms mainly employ synchronous communication, which may result in training inefficiencies under heterogeneous and dynamic edge environments. Although a few recent asynchronous DFL (ADFL) mechanisms have been proposed to address these issues, they typically yield stale model aggregation and frequent model transmission, leading to degraded training performance on non-IID data and high communication overhead. To overcome these issues, we present DySTop, an innovative mechanism that jointly optimizes dynamic staleness control and topology construction in ADFL. In each round, multiple workers are activated, and a subset of their neighbors is selected to transmit models for aggregation, followed by local training. We provide a rigorous convergence analysis for DySTop, theoretically revealing the quantitative relationships between the convergence bound and key factors such as maximum staleness, activating frequency, and data distribution among workers. From the insights of the analysis, we propose a worker activation algorithm (WAA) for staleness control and a phase-aware topology construction algorithm (PTCA) to reduce communication overhead and handle data non-IID. Extensive evaluations through both large-scale simulations and real-world testbed experiments demonstrate that our DySTop reduces completion time by 51.8% and the communication resource consumption by 57.1% compared to state-of-the-art solutions, while maintaining the same model accuracy.

cs.DC↗

arXiv2025

RetinaLogos: Fine-Grained Synthesis of High-Resolution Retinal Images Through Captions

The scarcity of high-quality, labelled retinal imaging data, which presents a significant challenge in the development of machine learning models for ophthalmology, hinders progress in the field. Existing methods for synthesising Colour Fundus Photographs (CFPs) largely rely on predefined disease labels, which restricts their ability to generate images that reflect fine-grained anatomical variations, subtle disease stages, and diverse pathological features beyond coarse class categories. To overcome these challenges, we first introduce an innovative pipeline that creates a large-scale, captioned retinal dataset comprising 1.4 million entries, called RetinaLogos-1400k. Specifically, RetinaLogos-1400k uses the visual language model(VLM) to describe retinal conditions and key structures, such as optic disc configuration, vascular distribution, nerve fibre layers, and pathological features. Building on this dataset, we employ a novel three-step training framework, RetinaLogos, which enables fine-grained semantic control over retinal images and accurately captures different stages of disease progression, subtle anatomical variations, and specific lesion types. Through extensive experiments, our method demonstrates superior performance across multiple datasets, with 62.07% of text-driven synthetic CFPs indistinguishable from real ones by ophthalmologists. Moreover, the synthetic data improves accuracy by 5%-10% in diabetic retinopathy grading and glaucoma detection. Codes are available at https://github.com/uni-medical/retina-text2cfp.

eess.IV↗

arXiv2025

Ophora: A Large-Scale Data-Driven Text-Guided Ophthalmic Surgical Video Generation Model

In ophthalmic surgery, developing an AI system capable of interpreting surgical videos and predicting subsequent operations requires numerous ophthalmic surgical videos with high-quality annotations, which are difficult to collect due to privacy concerns and labor consumption. Text-guided video generation (T2V) emerges as a promising solution to overcome this issue by generating ophthalmic surgical videos based on surgeon instructions. In this paper, we present Ophora, a pioneering model that can generate ophthalmic surgical videos following natural language instructions. To construct Ophora, we first propose a Comprehensive Data Curation pipeline to convert narrative ophthalmic surgical videos into a large-scale, high-quality dataset comprising over 160K video-instruction pairs, Ophora-160K. Then, we propose a Progressive Video-Instruction Tuning scheme to transfer rich spatial-temporal knowledge from a T2V model pre-trained on natural video-text datasets for privacy-preserved ophthalmic surgical video generation based on Ophora-160K. Experiments on video quality evaluation via quantitative analysis and ophthalmologist feedback demonstrate that Ophora can generate realistic and reliable ophthalmic surgical videos based on surgeon instructions. We also validate the capability of Ophora for empowering downstream tasks of ophthalmic surgical workflow understanding. Code is available at https://github.com/uni-medical/Ophora.

eess.IV↗

arXiv2025

Gradients as an Action: Towards Communication-Efficient Federated Recommender Systems via Adaptive Action Sharing

As a promising privacy-aware collaborative model training paradigm, Federated Learning (FL) is becoming popular in the design of distributed recommender systems. However, Federated Recommender Systems (FedRecs) greatly suffer from two major problems: i) extremely high communication overhead due to massive item embeddings involved in recommendation systems, and ii) intolerably low training efficiency caused by the entanglement of both heterogeneous network environments and client devices. Although existing methods attempt to employ various compression techniques to reduce communication overhead, due to the parameter errors introduced by model compression, they inevitably suffer from model performance degradation. To simultaneously address the above problems, this paper presents a communication-efficient FedRec framework named FedRAS, which adopts an action-sharing strategy to cluster the gradients of item embedding into a specific number of model updating actions for communication rather than directly compressing the item embeddings. In this way, the cloud server can use the limited actions from clients to update all the items. Since gradient values are significantly smaller than item embeddings, constraining the directions of gradients (i.e., the action space) introduces smaller errors compared to compressing the entire item embedding matrix into a reduced space. To accommodate heterogeneous devices and network environments, FedRAS incorporates an adaptive clustering mechanism that dynamically adjusts the number of actions. Comprehensive experiments on well-known datasets demonstrate that FedRAS can reduce the size of communication payloads by up to 96.88%, while not sacrificing recommendation performance within various heterogeneous scenarios. We have open-sourced FedRAS at https://github.com/mastlab-T3S/FedRAS.

cs.LG↗