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Researchers are investing substantial effort in developing powerful general-purpose agents, wherein Foundation Models are used as modules within agentic systems (e.g. Chain-of-Thought, Self-Reflection, Toolformer). However, the history of…

Artificial Intelligence · Computer Science 2025-03-04 Shengran Hu , Cong Lu , Jeff Clune

Advances in Agent Oriented Software Engineering have focused on the provision of frameworks and toolkits to aid in the creation of Multi Agent Systems (MASs). However, despite the need to address the inherent complexity of such systems,…

Multiagent Systems · Computer Science 2015-08-12 Dinh Doan Van Bien , David Lillis , Rem W. Collier

Large Language Model (LLM)-driven Multi-agent systems (Mas) have recently emerged as a powerful paradigm for tackling complex real-world tasks. However, existing Mas construction methods typically rely on manually crafted interaction…

Multiagent Systems · Computer Science 2025-06-13 Kuo Yang , Xingjie Yang , Linhui Yu , Qing Xu , Yan Fang , Xu Wang , Zhengyang Zhou , Yang Wang

Large Language Model (LLM)-empowered multi-agent systems extend the cognitive boundaries of individual agents through disciplined collaboration and interaction, while constructing these systems often requires labor-intensive manual designs.…

Machine Learning · Computer Science 2025-06-10 Guibin Zhang , Luyang Niu , Junfeng Fang , Kun Wang , Lei Bai , Xiang Wang

LLM-based agents are increasingly deployed in multi-agent systems (MAS). As these systems move toward real-world applications, their security becomes paramount. Existing research largely evaluates single-agent security, leaving a critical…

Multiagent Systems · Computer Science 2025-11-17 Nirmit Arora , Sathvik Joel , Ishan Kavathekar , Palak , Rohan Gandhi , Yash Pandya , Tanuja Ganu , Aditya Kanade , Akshay Nambi

Inverse design of materials has significantly advanced target-driven formulation optimization, yet existing materials machine learning benchmarks remain limited to forward property prediction, failing to systematically evaluate inverse…

Materials Science · Physics 2026-05-27 Linhan Wu , Chenxi Wang , Chuhan Yang , Zhengwei Yang , Yuyang Liu

While the complex reasoning capability of Large Language Models (LLMs) has attracted significant attention, single-agent systems often encounter inherent performance ceilings in complex tasks such as code generation. Multi-agent…

The convergence of artificial intelligence and materials science presents a transformative opportunity, but achieving true acceleration in discovery requires moving beyond task-isolated, fine-tuned models toward agentic systems that plan,…

Multi-Agent Systems (MAS) powered by Large Language Models (LLMs) are emerging as a powerful paradigm for solving complex, multifaceted problems. However, the potential of these systems is often constrained by the prevalent plan-and-execute…

Artificial Intelligence · Computer Science 2025-07-18 Yexuan Shi , Mingyu Wang , Yunxiang Cao , Hongjie Lai , Junjian Lan , Xin Han , Yu Wang , Jie Geng , Zhenan Li , Zihao Xia , Xiang Chen , Chen Li , Jian Xu , Wenbo Duan , Yuanshuo Zhu

Automated machine learning (AutoML) accelerates AI development by automating tasks in the development pipeline, such as optimal model search and hyperparameter tuning. Existing AutoML systems often require technical expertise to set up…

Machine Learning · Computer Science 2025-06-09 Patara Trirat , Wonyong Jeong , Sung Ju Hwang

The rapid advancement of large language models (LLMs) has led to the rise of LLM-based agents. Recent research shows that multi-agent systems (MAS), where each agent plays a specific role, can outperform individual LLMs. However,…

Computation and Language · Computer Science 2024-08-28 Chi-Min Chan , Jianxuan Yu , Weize Chen , Chunyang Jiang , Xinyu Liu , Weijie Shi , Zhiyuan Liu , Wei Xue , Yike Guo

Object rearrangement is a fundamental problem in robotics with various practical applications ranging from managing warehouses to cleaning and organizing home kitchens. While existing research has primarily focused on single-agent…

Robotics · Computer Science 2023-11-07 Vivek Gupta , Praphpreet Dhir , Jeegn Dani , Ahmed H. Qureshi

We present Smac Planner, an openly available, search-based planning framework that addresses the critical need for kinematically feasible path planning across diverse robot platforms. Smac Planner provides high-performance implementations…

Robotics · Computer Science 2025-05-12 Steve Macenski , Matthew Booker , Joshua Wallace , Tobias Fischer

Harnessing the rich nonlinear dynamics of highly-deformable materials has the potential to unlock the next generation of functional smart materials and devices. However, unlocking such potential requires effective strategies to spatially…

Organic solar cells (OSCs) hold great promise for sustainable energy, but discovering high-performance materials is time-consuming and costly. Existing molecular generation methods can aid the design of OSC molecules, but they are mostly…

Computational Engineering, Finance, and Science · Computer Science 2026-02-05 Zhaolin Hu , Zhiliang Wu , Hehe Fan , Yi Yang

LLM-based multi-agent systems (MAS) have emerged as a promising approach to tackle complex tasks that are difficult for individual LLMs. A natural strategy is to scale performance by increasing the number of agents; however, we find that…

Artificial Intelligence · Computer Science 2026-02-04 Yingxuan Yang , Chengrui Qu , Muning Wen , Laixi Shi , Ying Wen , Weinan Zhang , Adam Wierman , Shangding Gu

Agentic AI has significantly extended the capabilities of large language models (LLMs) by enabling complex reasoning and tool use. However, most existing frameworks are tailored to domains such as mathematics, coding, or web automation, and…

Artificial Intelligence · Computer Science 2025-10-15 Md Hasebul Hasan , Mahir Labib Dihan , Tanzima Hashem , Mohammed Eunus Ali , Md Rizwan Parvez

The integration of Artificial Intelligence (AI) with High-Performance Computing (HPC) is transforming scientific workflows from human-directed pipelines into adaptive systems capable of autonomous decision-making. Large language models…

Vehicle motion planning is an essential component of autonomous driving technology. Current rule-based vehicle motion planning methods perform satisfactorily in common scenarios but struggle to generalize to long-tailed situations.…

Single-atom metal alloy catalysts (SAACs) have recently become a very active new frontier in catalysis research. The simultaneous optimization of both facile dissociation of reactants and a balanced strength of intermediates' binding make…

Materials Science · Physics 2021-04-14 Zhong-Kang Han , Debalaya Sarker , Runhai Ouyang , Yi Gao , Sergey V. Levchenko