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Multi-agent systems (MAS) leveraging the impressive capabilities of Large Language Models (LLMs) hold significant potential for tackling complex tasks. However, most current MAS depend on manually designed agent roles and communication…

Computation and Language · Computer Science 2026-03-10 Zixuan Ke , Austin Xu , Yifei Ming , Xuan-Phi Nguyen , Ryan Chin , Caiming Xiong , Shafiq Joty

The proliferation of large language models (LLMs) has accelerated the adoption of agent-based workflows, where multiple autonomous agents reason, invoke functions, and collaborate to compose complex data pipelines. However, current…

Databases · Computer Science 2025-12-15 Zoi Kaoudi , Ioana Giurgiu

Hardware-Aware Neural Architecture Search (HW-NAS) requires joint optimization of accuracy and latency under device constraints. Traditional supernet-based methods require multiple GPU days per dataset. Large Language Model (LLM)-driven…

Machine Learning · Computer Science 2025-12-08 Hengyi Zhu , Grace Li Zhang , Shaoyi Huang

Topological materials occupy a frontier in condensed-matter physics thanks to their remarkable electronic and quantum properties, yet their cross-scale design remains bottlenecked by inefficient discovery workflows. Here, we introduce…

Materials Science · Physics 2025-07-08 Baohua Zhang , Xin Li , Huangchao Xu , Zhong Jin , Quansheng Wu , Ce Li

Artificial neural network (NN) architecture design is a nontrivial and time-consuming task that often requires a high level of human expertise. Neural architecture search (NAS) serves to automate the design of NN architectures and has…

Neural and Evolutionary Computing · Computer Science 2024-09-10 Reinhard Booysen , Anna Sergeevna Bosman

This paper investigates the inverse capabilities and broader utility of multimodal latent spaces within task-specific AI (Artificial Intelligence) models. While these models excel at their designed forward tasks (e.g., text-to-image…

Machine Learning · Computer Science 2025-08-01 Siwoo Park

The integration of large language models (LLMs) with external tools has significantly expanded the capabilities of AI agents. However, as the diversity of both LLMs and tools increases, selecting the optimal model-tool combination becomes a…

Computation and Language · Computer Science 2026-01-08 Jinyang Wu , Guocheng Zhai , Ruihan Jin , Jiahao Yuan , Yuhao Shen , Shuai Zhang , Zhengqi Wen , Jianhua Tao

Automatic Heuristic Design (AHD) is an effective framework for solving complex optimization problems. The development of large language models (LLMs) enables the automated generation of heuristics. Existing LLM-based evolutionary methods…

Artificial Intelligence · Computer Science 2025-12-12 Hui Wang , Yang Liu , Xiaoyu Zhang , Chaoxu Mu

While Large Language Models (LLMs) have recently shown promise in Automated Heuristic Design (AHD), existing approaches typically formulate AHD around constructive priority rules or parameterized local search guidance, thereby restricting…

Artificial Intelligence · Computer Science 2026-02-10 Baoyun Zhao , He Wang , Liang Zeng

Service system performance depends on how participants respond to design choices, but modeling these responses is hard due to the complexity of human behavior. We introduce an LLM-powered multi-agent simulation (LLM-MAS) framework for…

Artificial Intelligence · Computer Science 2026-04-07 Yanyuan Wang , Xiaowei Zhang

Large Language Models (LLMs) agents augmented with domain tools promise to autonomously execute complex tasks requiring human-level intelligence, such as customer service and digital assistance. However, their practical deployment is often…

Multiagent Systems · Computer Science 2025-08-28 Kevin Song , Anand Jayarajan , Yaoyao Ding , Qidong Su , Zhanda Zhu , Sihang Liu , Gennady Pekhimenko

The integration of Large Language Models (LLMs) into evolutionary frameworks has established a new paradigm for automated heuristic discovery. Despite their promise, these methods typically search in the discrete space of program syntax,…

Artificial Intelligence · Computer Science 2026-05-19 Cheikh Ahmed , Mahdi Mostajabdaveh , Zirui Zhou

Building deep reinforcement learning agents that can generalize and adapt to unseen environments remains a fundamental challenge for AI. This paper describes progresses on this challenge in the context of man-made environments, which are…

Machine Learning · Computer Science 2018-10-01 Yi Wu , Yuxin Wu , Aviv Tamar , Stuart Russell , Georgia Gkioxari , Yuandong Tian

In this work we have extended AutoML inspired approaches to the exploration and optimization of neuromorphic architectures. Through the integration of a parallel asynchronous model-based search approach with a simulation framework to…

Neural and Evolutionary Computing · Computer Science 2023-02-28 Angel Yanguas-Gil , Sandeep Madireddy

Multi-agent systems (MAS) based on large language models (LLMs) have emerged as a powerful solution for dealing with complex problems across diverse domains. The effectiveness of MAS is critically dependent on its collaboration topology,…

Multiagent Systems · Computer Science 2025-11-20 Shiyuan Li , Yixin Liu , Qingsong Wen , Chengqi Zhang , Shirui Pan

Large Language Models (LLM) are increasingly being explored for problem-solving tasks. However, their strategic planning capability is often viewed with skepticism. Recent studies have incorporated the Monte Carlo Tree Search (MCTS)…

Artificial Intelligence · Computer Science 2025-02-05 Bingzheng Gan , Yufan Zhao , Tianyi Zhang , Jing Huang , Yusu Li , Shu Xian Teo , Changwang Zhang , Wei Shi

Existing object-search approaches enable robots to search through free pathways, however, robots operating in unstructured human-centered environments frequently also have to manipulate the environment to their needs. In this work, we…

Robotics · Computer Science 2023-11-07 Fabian Schmalstieg , Daniel Honerkamp , Tim Welschehold , Abhinav Valada

Given the remarkable performance of Large Language Models (LLMs), an important question arises: Can LLMs conduct human-like scientific research and discover new knowledge, and act as an AI scientist? Scientific discovery is an iterative…

Machine Learning · Computer Science 2025-02-24 Tingting Chen , Srinivas Anumasa , Beibei Lin , Vedant Shah , Anirudh Goyal , Dianbo Liu

While Large Language Models (LLMs) have shown remarkable advancements in reasoning and tool use, they often fail to generate optimal, grounded solutions under complex constraints. Real-world travel planning exemplifies these challenges,…

Artificial Intelligence · Computer Science 2025-10-01 Jihye Choi , Jinsung Yoon , Jiefeng Chen , Somesh Jha , Tomas Pfister

Identifying reliable synthesis pathways in materials chemistry is a complex task, particularly in polymer science, due to the intricate and often non-unique nomenclature of macromolecules. To address this challenge, we propose an agent…

Artificial Intelligence · Computer Science 2025-04-16 Qinyu Ma , Yuhao Zhou , Jianfeng Li