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Generative models and machine learning promise accelerated material discovery in MOFs for CO2 capture and water harvesting but face significant challenges navigating vast chemical spaces while ensuring synthetizability. Here, we present…

Retrieval-augmented generation (RAG) is increasingly recognized as an effective approach to mitigating the hallucination of large language models (LLMs) through the integration of external knowledge. While numerous efforts, most studies…

Computation and Language · Computer Science 2025-10-10 Shuo Yu , Mingyue Cheng , Qi Liu , Daoyu Wang , Jiqian Yang , Jie Ouyang , Yucong Luo , Chenyi Lei , Enhong Chen

Retrieval-Augmented Generation (RAG) is an effective approach to enhance the factual accuracy of large language models (LLMs) by retrieving information from external databases, which are typically composed of diverse sources, to supplement…

Machine Learning · Computer Science 2025-10-15 Jeongyeon Hwang , Junyoung Park , Hyejin Park , Dongwoo Kim , Sangdon Park , Jungseul Ok

Retrieval-augmented generation (RAG) integrates large language models ( LLM s) with retrievers to access external knowledge, improving the factuality of LLM generation in knowledge-grounded tasks. To optimize the RAG performance, most…

Information Retrieval · Computer Science 2025-05-07 Zhengliang Shi , Lingyong Yan , Weiwei Sun , Yue Feng , Pengjie Ren , Xinyu Ma , Shuaiqiang Wang , Dawei Yin , Maarten de Rijke , Zhaochun Ren

While large language models (LLMs) have achieved state-of-the-art performance on a wide range of medical question answering (QA) tasks, they still face challenges with hallucinations and outdated knowledge. Retrieval-augmented generation…

Computation and Language · Computer Science 2024-02-26 Guangzhi Xiong , Qiao Jin , Zhiyong Lu , Aidong Zhang

Despite rapid progress in large language model (LLM)-based multi-agent systems, current benchmarks fall short in evaluating their scalability, robustness, and coordination capabilities in complex, dynamic, real-world tasks. Existing…

Multiagent Systems · Computer Science 2025-12-15 Jonathan Hyun , Nicholas R Waytowich , Boyuan Chen

Developers spend much time finding information that is relevant to their questions. Stack Overflow has been the leading resource, and with the advent of Large Language Models (LLMs), generative models such as ChatGPT are used frequently.…

Artificial Intelligence · Computer Science 2024-06-21 Davit Abrahamyan , Fatemeh H. Fard

Retrieval-augmented generation (RAG) enhances large language models (LLMs) by integrating external knowledge retrieved at inference time. While RAG demonstrates strong performance on benchmarks largely derived from general-domain corpora…

Computation and Language · Computer Science 2025-07-29 Ran Xu , Yuchen Zhuang , Yue Yu , Haoyu Wang , Wenqi Shi , Carl Yang

Recent advancements in Large language models (LLMs) have demonstrated remarkable capabilities across diverse domains. While they exhibit strong zero-shot performance on various tasks, LLMs' effectiveness in music-related applications…

Computation and Language · Computer Science 2025-12-09 Daeyong Kwon , SeungHeon Doh , Juhan Nam

Large Language Models (LLMs) demonstrate remarkable capabilities in various reasoning tasks. However, they encounter significant challenges when it comes to scientific reasoning, particularly in physics, which requires not only mathematical…

Artificial Intelligence · Computer Science 2024-12-03 Raj Jaiswal , Dhruv Jain , Harsh Parimal Popat , Avinash Anand , Abhishek Dharmadhikari , Atharva Marathe , Rajiv Ratn Shah

Agentic systems enable the intelligent use of research tooling, augmenting a researcher's ability to investigate and propose novel solutions to existing problems. Within Additive Manufacturing (AM), alloy selection and evaluation remains a…

Artificial Intelligence · Computer Science 2026-01-27 Peter Pak , Achuth Chandrasekhar , Amir Barati Farimani

Retrieval-Augmented Generation (RAG) has emerged as a powerful paradigm for enhancing large language models (LLMs) by retrieving relevant documents from an external corpus. However, existing RAG systems primarily focus on unimodal text…

Computation and Language · Computer Science 2025-10-21 Chenghao Zhang , Guanting Dong , Xinyu Yang , Zhicheng Dou

Large Language Models (LLMs) have extended their impact beyond Natural Language Processing, substantially fostering the development of interdisciplinary research. Recently, various LLM-based agents have been developed to assist scientific…

Retrieval-augmented generation (RAG) enhances large language models (LLMs) by integrating external knowledge sources to address their limitations in accessing up-to-date or specialized information. A natural strategy to increase the…

Computation and Language · Computer Science 2025-11-10 Song Wang , Zihan Chen , Peng Wang , Zhepei Wei , Zhen Tan , Yu Meng , Cong Shen , Jundong Li

Large language models (LLMs) struggle to effectively utilize a growing number of external tools, such as those defined by the Model Context Protocol (MCP)\cite{IntroducingMCP}, due to prompt bloat and selection complexity. We introduce…

Artificial Intelligence · Computer Science 2025-05-07 Tiantian Gan , Qiyao Sun

Integrating Retrieval Augmented Generation (RAG) with Large Language Models (LLMs) has shown the potential to provide precise, contextually relevant responses in knowledge intensive domains. This study investigates the ap-plication of RAG…

Artificial Intelligence · Computer Science 2025-05-26 Salahuddin Alawadhi , Noorhan Abbas

Background The increasing adoption of Artificial Intelligence (AI) in healthcare has sparked growing concerns about its environmental and ethical implications. Commercial Large Language Models (LLMs), such as ChatGPT and DeepSeek, require…

Artificial Intelligence · Computer Science 2025-06-26 Konstantinos Vrettos , Michail E. Klontzas

Retrieval-Augmented Generation (RAG) aims to augment the capabilities of Large Language Models (LLMs) by retrieving and incorporate external documents or chunks prior to generation. However, even improved retriever relevance can brings…

Computation and Language · Computer Science 2025-04-29 Sha Li , Naren Ramakrishnan

Retrieval-Augmented Generation (RAG) has gained significant attention in recent years for its potential to enhance natural language understanding and generation by combining large-scale retrieval systems with generative models. RAG…

Computation and Language · Computer Science 2025-03-18 Mingyue Cheng , Yucong Luo , Jie Ouyang , Qi Liu , Huijie Liu , Li Li , Shuo Yu , Bohou Zhang , Jiawei Cao , Jie Ma , Daoyu Wang , Enhong Chen

Large Language Models (LLMs) have achieved impressive performance across a wide range of applications. However, they often suffer from hallucinations in knowledge-intensive domains due to their reliance on static pretraining corpora. To…

Information Retrieval · Computer Science 2026-02-10 Lihui Liu , Jiayuan Ding , Subhabrata Mukherjee , Carl J. Yang