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We introduce the concept of "Design Agents" for engineering applications, particularly focusing on the automotive design process, while emphasizing that our approach can be readily extended to other engineering and design domains. Our…

Artificial Intelligence · Computer Science 2025-12-04 Mohamed Elrefaie , Janet Qian , Raina Wu , Qian Chen , Angela Dai , Faez Ahmed

Agentic AI systems integrating large language models (LLMs) with reasoning and tooluse capabilities are transforming various domains - in particular, software development. In contrast, their application in chemical process flowsheet…

Artificial Intelligence · Computer Science 2026-03-16 Pascal Schäfer , Lukas J. Krinke , Martin Wlotzka , Norbert Asprion

Model fusion is a key strategy for robust recognition in unconstrained scenarios, as different models provide complementary strengths. This is especially important for whole-body human recognition, where biometric cues such as face, gait,…

Computer Vision and Pattern Recognition · Computer Science 2026-03-31 Jie Zhu , Xiao Guo , Yiyang Su , Anil Jain , Xiaoming Liu

Metal-organic frameworks (MOFs) offer a vast design space, and as such, computational simulations play a critical role in predicting their structural and physicochemical properties. However, MOF simulations remain difficult to access…

Artificial Intelligence · Computer Science 2026-04-01 Jaewoong Lee , Taeun Bae , Jihan Kim

Omnimodal large language models have made significant strides in unifying audio and visual modalities; however, they often face challenges in fine-grained cross-modal understanding and have difficulty with multimodal alignment. To address…

Computer Vision and Pattern Recognition · Computer Science 2026-02-06 Keda Tao , Wenjie Du , Bohan Yu , Weiqiang Wang , Jian Liu , Huan Wang

Configuring computational fluid dynamics (CFD) simulations requires significant expertise in physics modeling and numerical methods, posing a barrier to non-specialists. Although automating scientific tasks with large language models (LLMs)…

Software Engineering · Computer Science 2025-12-10 Zhehao Dong , Shanghai Du , Zhen Lu , Yue Yang

We introduce ToPolyAgent, a multi-agent AI framework for performing coarse-grained molecular dynamics (MD) simulations of topological polymers through natural language instructions. By integrating large language models (LLMs) with…

Artificial Intelligence · Computer Science 2026-02-09 Lijie Ding , Jan-Michael Carrillo , Changwoo Do

Financial markets pose fundamental challenges for asset return prediction due to their high dimensionality, non-stationarity, and persistent volatility. Despite advances in large language models and multi-agent systems, current quantitative…

Computational Finance · Quantitative Finance 2025-09-26 Yuante Li , Xu Yang , Xiao Yang , Minrui Xu , Xisen Wang , Weiqing Liu , Jiang Bian

The integration of workflows with large language models (LLMs) enables LLM-based agents to execute predefined procedures, enhancing automation in real-world applications. Traditional rule-based methods tend to limit the inherent flexibility…

Artificial Intelligence · Computer Science 2025-02-21 Yuchen Shi , Siqi Cai , Zihan Xu , Yuei Qin , Gang Li , Hang Shao , Jiawei Chen , Deqing Yang , Ke Li , Xing Sun

Large Language Model (LLM) Agents have demonstrated remarkable capabilities in task automation and intelligent decision-making, driving the widespread adoption of agent development frameworks such as LangChain and AutoGen. However, these…

Artificial Intelligence · Computer Science 2025-10-10 Jiabin Tang , Tianyu Fan , Chao Huang

As cities evolve toward more complex and multimodal transportation systems, the need for human-centered multi-agent simulation tools has never been more urgent. Yet most existing platforms remain limited - they often separate different…

Multiagent Systems · Computer Science 2025-07-16 Shiva Azimi , Arash Tavakoli

Multiconfiguration pair-density functional theory (MC-PDFT) offers an efficient and accurate framework for computing electronic energies in strongly correlated molecular systems, with the quality of the on-top functional being a key…

Chemical Physics · Physics 2026-05-08 Yuhao Chen , Donald G. Truhlar , Xiao He

Existing LLM-enabled multi-agent frameworks are predominantly limited to digital or simulated environments and confined to narrowly focused knowledge domain, constraining their applicability to complex engineering tasks that require the…

Virtual film production requires intricate decision-making processes, including scriptwriting, virtual cinematography, and precise actor positioning and actions. Motivated by recent advances in automated decision-making with language…

Computation and Language · Computer Science 2025-01-23 Zhenran Xu , Longyue Wang , Jifang Wang , Zhouyi Li , Senbao Shi , Xue Yang , Yiyu Wang , Baotian Hu , Jun Yu , Min Zhang

Combining machine learning (ML) with computational fluid dynamics (CFD) opens many possibilities for improving simulations of technical and natural systems. However, CFD+ML algorithms require exchange of data, synchronization, and…

Machine Learning · Computer Science 2024-06-25 Tomislav Maric , Mohammed Elwardi Fadeli , Alessandro Rigazzi , Andrew Shao , Andre Weiner

Computational fluid dynamics (CFD) drives progress in numerous scientific and engineering fields, yet high-fidelity simulations remain computationally prohibitive. While machine learning approaches offer computing acceleration, they…

Fluid Dynamics · Physics 2025-08-12 Rui Zhang , Qi Meng , Han Wan , Yang Liu , Zhi-Ming Ma , Hao Sun

Agent-based modeling is indispensable for studying complex systems across many domains. However, existing simulation platforms exhibit two major issues: performance and modularity. Low performance prevents simulations with a large number of…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-03-17 Lukas Johannes Breitwieser

Large Language Models (LLMs) have demonstrated the ability to solve a wide range of practical tasks within multi-agent systems. However, existing human-designed multi-agent frameworks are typically limited to a small set of pre-defined…

Artificial Intelligence · Computer Science 2025-07-31 Yaolun Zhang , Xiaogeng Liu , Chaowei Xiao

In recent years, agentic workflows have been widely applied to solve complex human tasks. However, existing workflow construction still faces key challenges, including human-dependent workflow construction, the lack of graph-level execution…

Artificial Intelligence · Computer Science 2026-05-15 Mingda Zhang , Wenjin Liu , Tiesunlong Shen , Qika Lin , Rui Mao , Erik Cambria , Xiaoying Tang , Haoran Luo

With the advancement of Multimodal Large Language Models (MLLM), LLM-driven visual agents are increasingly impacting software interfaces, particularly those with graphical user interfaces. This work introduces a novel LLM-based multimodal…

Human-Computer Interaction · Computer Science 2025-09-18 Yanda Li , Chi Zhang , Wenjia Jiang , Wanqi Yang , Bin Fu , Pei Cheng , Xin Chen , Ling Chen , Yunchao Wei