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Related papers: LLM-guided phase diagram construction through high…

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In recent years, large language models (LLMs) have demonstrated significant potential in complex reasoning tasks like mathematical problem-solving. However, existing research predominantly relies on reinforcement learning (RL) frameworks…

Machine Learning · Computer Science 2026-01-12 ShaoZhen Liu , Xinting Huang , Houwen Peng , Xin Chen , Xinyang Song , Qi Li , Zhenan Sun

Understanding large-scale, complex software systems is a major challenge for developers, who spend a significant portion of their time on program comprehension. Traditional tools such as static visualizations and reverse engineering…

Software Engineering · Computer Science 2025-08-11 Yoseph Berhanu Alebachew

We consider the issue of calibration in large language models (LLM). Recent studies have found that common interventions such as instruction tuning often result in poorly calibrated LLMs. Although calibration is well-explored in traditional…

Machine Learning · Computer Science 2024-06-28 Maohao Shen , Subhro Das , Kristjan Greenewald , Prasanna Sattigeri , Gregory Wornell , Soumya Ghosh

Computational social experiments, which typically employ agent-based modeling to create testbeds for piloting social experiments, not only provide a computational solution to the major challenges faced by traditional experimental methods,…

Computers and Society · Computer Science 2025-08-13 Jinghua Piao , Yuwei Yan , Nian Li , Jun Zhang , Yong Li

The rapid integration of Large Language Models (LLMs) into software engineering practice is reshaping how software testing activities are performed. LLMs are increasingly used to support software testing. Consequently, software testing…

Software Engineering · Computer Science 2026-03-30 Peng Yang , Yunfeng Zhu , Chao Chang , Shengcheng Yu , Zhenyu Chen , Yong Tang

A Large Language Model (LLM) represents a cutting-edge artificial intelligence model that generates coherent content, including grammatically precise sentences, human-like paragraphs, and syntactically accurate code snippets. LLMs can play…

Software Engineering · Computer Science 2023-12-11 Robson Santos , Italo Santos , Cleyton Magalhaes , Ronnie de Souza Santos

Validation is a central activity when developing formal specifications. Similarly to coding, a possible validation technique is to define upfront test cases or scenarios that a future specification should satisfy or not. Unfortunately,…

Software Engineering · Computer Science 2026-02-19 Alcino Cunha , Nuno Macedo

LLM systems must make control decisions in addition to generating outputs: whether to answer, clarify, retrieve, call tools, repair, or escalate. In many current architectures, these decisions remain implicit within generation, entangling…

Artificial Intelligence · Computer Science 2026-04-02 Wei Sun

Large Language models (LLMs) have shown promise as generators of symbolic control policies, producing interpretable program-like representations through iterative search. However, these models are not capable of separating the functional…

Machine Learning · Computer Science 2025-10-02 Carlo Bosio , Matteo Guarrera , Alberto Sangiovanni-Vincentelli , Mark W. Mueller

Large Language Models (LLMs) excel at many tasks but often falter on complex problems that require structured, multi-step reasoning. We introduce the Diagram of Thought (DoT), a framework that enables a single LLM to build and navigate a…

Computation and Language · Computer Science 2026-05-15 Yifan Zhang , Yang Yuan , Andrew Chi-Chih Yao

Phase diagrams are an invaluable tool for material synthesis and provide information on the phases of the material at any given thermodynamic condition. Conventional phase diagram generation involves experimentation to provide an initial…

The potential of large language models (LLMs) to mitigate the time- and cost- related challenges associated with inductive thematic analysis (ITA) has been extensively explored in the literature. However, the use of LLMs to support ITA has…

Human-Computer Interaction · Computer Science 2025-04-01 Muhammad Talal Khalid , Ann-Perry Witmer

Engineers widely rely on simulation platforms like COMSOL or ANSYS to model and optimise processes. However, setting up such simulations requires expertise in defining geometry, generating meshes, establishing boundary conditions, and…

Computational Engineering, Finance, and Science · Computer Science 2025-03-25 Ossama Shafiq , Bahman Ghiassi , Alessio Alexiadis

The emergence of Large Language Models (LLMs) has opened new opportunities to automate software engineering activities that traditionally require substantial manual effort. Among these, class diagram generation represents a critical yet…

Software Engineering · Computer Science 2026-03-11 Jackson Nguyen , Rui En Koe , Fanyu Wang , Chetan Arora , Alessio Ferrari

Autoregressive Large Language Models (AR-LLMs) are widely used in software engineering (SE) but face limitations in processing code structure information and suffer from high inference latency. Diffusion LLMs (DLLMs) offer a promising…

Software Engineering · Computer Science 2025-10-07 Jingyao Zhang , Tianlin Li , Xiaoyu Zhang , Qiang Hu , Bin Shi

Large Language Models (LLMs) are increasingly utilized for domain-specific tasks, yet evaluating their outputs remains challenging. A common strategy is to apply evaluation criteria to assess alignment with domain-specific standards, yet…

Human-Computer Interaction · Computer Science 2026-02-17 Annalisa Szymanski , Simret Araya Gebreegziabher , Oghenemaro Anuyah , Ronald A. Metoyer , Toby Jia-Jun Li

[Context] Large Language Models (LLMs) are increasingly used to assist qualitative research in Software Engineering (SE), yet the methodological implications of this usage remain underexplored. Their integration into interpretive processes…

Software Engineering · Computer Science 2025-11-19 Tatiane Ornelas , Allysson Allex Araújo , Júlia Araújo , Marina Araújo , Bianca Trinkenreich , Marcos Kalinowski

A common approach for teaching large language models (LLMs) to reason is to train on chain-of-thought (CoT) traces of in-distribution reasoning problems, but such annotated data is costly to obtain for every problem of interest. We want…

Computation and Language · Computer Science 2025-05-29 Fangcong Yin , Zeyu Leo Liu , Liu Leqi , Xi Ye , Greg Durrett

The development of large language models (LLMs) has brought unprecedented possibilities for artificial intelligence (AI) based medical diagnosis. However, the application perspective of LLMs in real diagnostic scenarios is still unclear…

Computation and Language · Computer Science 2024-05-21 Zhoujian Sun , Cheng Luo , Ziyi Liu , Zhengxing Huang

The integration of large language models (LLMs) into automated algorithm design has shown promising potential. A prevalent approach embeds LLMs within search routines to iteratively generate and refine candidate algorithms. However, most…

Machine Learning · Computer Science 2026-05-20 Fei Liu , Rui Zhang , Xi Lin , Zhichao Lu , Qingfu Zhang