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Recent advances in generative AI have accelerated the discovery of novel chemicals and materials. However, scaling these discoveries to industrial production remains a major bottleneck due to the synthesis gap -- the need to develop…

Machine Learning · Computer Science 2025-08-19 Sakhinana Sagar Srinivas , Shivam Gupta , Venkataramana Runkana

The increasing complexity of modern chemical processes, coupled with workforce shortages and intricate fault scenarios, demands novel automation paradigms that blend symbolic reasoning with adaptive control. In this work, we introduce a…

Artificial Intelligence · Computer Science 2025-07-11 Javal Vyas , Mehmet Mercangoz

Large Language Model (LLM)-based multi-agent systems are increasingly applied to automate computational workflows in science and engineering. However, how inter-agent dynamics influence reasoning quality and verification reliability remains…

Artificial Intelligence · Computer Science 2025-11-07 Chuan Tian , Yilei Zhang

To accelerate mechanical design and enhance design quality and innovation, we present a Multidisciplinary Design and Optimization (MDO) Agent driven by Large Language Models (LLMs). The agent semi-automates the end-to-end workflow by…

Human-Computer Interaction · Computer Science 2025-11-25 Bingkun Guo , Wentian Li , Xiaojian Liu , Jiaqi Luo , Zibin Yu , Dalong Dong , Shuyou Zhang , Yiming Zhang

Computer-aided design (CAD) is the digital construction of 2D and 3D objects, and is central to a wide range of engineering and manufacturing applications like automobile and aviation. Despite its importance, CAD modeling remains largely a…

Graphics · Computer Science 2026-01-09 Prashant Govindarajan , Davide Baldelli , Jay Pathak , Quentin Fournier , Sarath Chandar

Foundation models, including large language models (LLMs) and vision-language models (VLMs), have recently enabled novel approaches to robot autonomy and human-robot interfaces. In parallel, vision-language-action models (VLAs) or large…

Finite element (FE) analysis guides the design and verification of nearly all manufactured objects. It is at the core of computational engineering, enabling simulation of complex physical systems, from fluids and solids to multiphysics…

Computational Engineering, Finance, and Science · Computer Science 2026-04-15 Rushikesh Deotale , Adithya Srinivasan , Yuan Tian , Tianyi Zhang , Pavlos Vlachos , Hector Gomez

Software architecture design is a fundamental part of creating every software system. Despite its importance, producing a C4 software architecture model, the preferred notation for such architecture, remains manual and time-consuming. We…

Software Engineering · Computer Science 2025-10-28 Kamil Szczepanik , Jarosław A. Chudziak

Large Language Model(LLM) inference demands massive compute and energy, making domain-specific tasks expensive and unsustainable. As foundation models keep scaling, we ask: Is bigger always better for hardware design? Our work tests this by…

The design of complex machines stands as both a marker of human intelligence and a foundation of engineering practice. Given recent advances in large language models (LLMs), we ask whether they, too, can learn to create. We approach this…

Artificial Intelligence · Computer Science 2025-10-21 Wenqian Zhang , Weiyang Liu , Zhen Liu

We propose a novel model- and feature-based approach to development of vehicle software systems, where the end architecture is not explicitly defined. Instead, it emerges from an iterative process of search and optimization given certain…

Software Engineering · Computer Science 2024-03-22 Krzysztof Lebioda , Viktor Vorobev , Nenad Petrovic , Fengjunjie Pan , Vahid Zolfaghari , Alois Knoll

Designing Verilog modules requires meticulous attention to correctness, efficiency, and adherence to design specifications. However, manually writing Verilog code remains a complex and time-consuming task that demands both expert knowledge…

Hardware Architecture · Computer Science 2025-04-17 Bardia Nadimi , Ghali Omar Boutaib , Hao Zheng

Solving mechanics problems using numerical methods requires comprehensive intelligent capability of retrieving relevant knowledge and theory, constructing and executing codes, analyzing the results, a task that has thus far mainly been…

Artificial Intelligence · Computer Science 2023-11-15 Bo Ni , Markus J. Buehler

Current Large Language Models (LLMs) are confronted with overwhelming information volume when comprehending long-form documents. This challenge raises the imperative of a cohesive memory module, which can elevate vanilla LLMs into…

Computation and Language · Computer Science 2025-10-08 Rui Li , Zeyu Zhang , Xiaohe Bo , Zihang Tian , Xu Chen , Quanyu Dai , Zhenhua Dong , Ruiming Tang

Foundation models, including large language models (LLMs), are increasingly used for human-in-the-loop (HITL) cyber-physical systems (CPS) because foundation model-based AI agents can potentially interact with both the physical environments…

Artificial Intelligence · Computer Science 2026-04-14 Deeksha Prahlad , Daniel Fan , Hokeun Kim

The growing complexity of power systems has made accurate load forecasting more important than ever. An increasing number of advanced load forecasting methods have been developed. However, the static design of current methods offers no…

Machine Learning · Computer Science 2025-05-23 Yu Zuo , Dalin Qin , Yi Wang

AI agentic programming is an emerging paradigm where large language model (LLM)-based coding agents autonomously plan, execute, and interact with tools such as compilers, debuggers, and version control systems. Unlike conventional code…

Software Engineering · Computer Science 2025-09-16 Huanting Wang , Jingzhi Gong , Huawei Zhang , Jie Xu , Zheng Wang

As chemical plants evolve towards full autonomy, the need for effective fault handling and control in dynamic, unpredictable environments becomes increasingly critical. This paper proposes an innovative approach to industrial automation,…

Multiagent Systems · Computer Science 2026-02-11 Javal Vyas , Mehmet Mercangöz

The realization of intelligent robots, operating autonomously and interacting with other intelligent agents, human or artificial, requires the integration of environment perception, reasoning, and action. Classic Artificial Intelligence…

Robotics · Computer Science 2025-12-15 Kanisorn Sangchai , Methasit Boonpun , Withawin Kraipetchara , Paulo Garcia

Iterative LLM systems(self-refinement, chain-of-thought, autonomous agents) are increasingly deployed, yet their temporal dynamics remain uncharacterized. Prior work evaluates task performance at convergence but ignores the trajectory: how…

Machine Learning · Computer Science 2026-02-02 Nicolas Tacheny