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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…

人工智能 · 计算机科学 2026-04-01 Jaewoong Lee , Taeun Bae , Jihan Kim

We use prompt engineering to guide ChatGPT in the automation of text mining of metal-organic frameworks (MOFs) synthesis conditions from diverse formats and styles of the scientific literature. This effectively mitigates ChatGPT's tendency…

信息检索 · 计算机科学 2023-10-04 Zhiling Zheng , Oufan Zhang , Christian Borgs , Jennifer T. Chayes , Omar M. Yaghi

Advances in generative artificial intelligence are transforming how metal-organic frameworks (MOFs) are designed and discovered. This Perspective introduces the shift from laborious enumeration of MOF candidates to generative approaches…

This research was focused on the efficient collection of experimental Metal-Organic Framework (MOF) data from scientific literature to address the challenges of accessing hard-to-find data and improving the quality of information available…

材料科学 · 物理学 2024-04-23 Wonseok Lee , Yeonghun Kang , Taeun Bae , Jihan Kim

This work addresses the question of how generative artificial intelligence can be used to reduce the time required to set up electromagnetic simulation models. A chatbot based on a large language model is presented, enabling the automated…

计算工程、金融与科学 · 计算机科学 2026-03-11 Albert Piwonski , Mirsad Hadžiefendić

Metal-organic framework (MOF) databases have grown rapidly through experimental deposition and large-scale literature extraction, but recent analyses show that nearly half of their entries contain substantial structural errors. These…

数据库 · 计算机科学 2026-04-06 Honghui Kim , Dohoon Kim , Jihan Kim

Metal-organic frameworks (MOFs) are porous crystalline materials with broad applications such as carbon capture and drug delivery, yet accurately predicting their 3D structures remains a significant challenge. While Large Language Models…

机器学习 · 计算机科学 2026-01-15 Mianzhi Pan , JianFei Li , Peishuo Liu , Botian Wang , Yawen Ouyang , Yiming Rong , Hao Zhou , Jianbing Zhang

The prediction of chemical synthesis pathways plays a pivotal role in materials science research. Challenges, such as the complexity of synthesis pathways and the lack of comprehensive datasets, currently hinder our ability to predict these…

材料科学 · 物理学 2023-11-03 Ziyi Chen , Fankai Xie , Meng Wan , Yang Yuan , Miao Liu , Zongguo Wang , Sheng Meng , Yangang Wang

The advent of artificial intelligence (AI) has enabled a comprehensive exploration of materials for various applications. However, AI models often prioritize frequently encountered materials in the scientific literature, limiting the…

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…

The use of chatbots has spread, generating great interest in the industry for the possibility of automating tasks within the execution of their processes. The implementation of chatbots, however simple, is a complex endeavor that involves…

软件工程 · 计算机科学 2021-09-03 Bedilia Estrada-Torres , Adela del-Río-Ortega , Manuel Resinas

Large language models(LLM) such as ChatGPT have substantially simplified the generation of marketing copy, yet producing content satisfying domain specific requirements, such as effectively engaging customers, remains a significant…

计算与语言 · 计算机科学 2024-02-22 Jianghui Zhou , Ya Gao , Jie Liu , Xuemin Zhao , Zhaohua Yang , Yue Wu , Lirong Shi

Large language models have demonstrated remarkable reasoning capabilities across diverse natural language tasks. However, comparable breakthroughs in scientific discovery are more limited, because understanding complex physical phenomena…

机器学习 · 计算机科学 2025-10-27 Jiyu Cui , Fang Wu , Haokai Zhao , Minggao Feng , Xenophon Evangelopoulos , Andrew I. Cooper , Yejin Choi

Large Language Models (LLMs), such as ChatGPT, demonstrate a strong understanding of human natural language and have been explored and applied in various fields, including reasoning, creative writing, code generation, translation, and…

人工智能 · 计算机科学 2023-05-30 Zhenlong Li , Huan Ning

Existing works focus on fixed-size layout pattern generation, while the more practical free-size pattern generation receives limited attention. In this paper, we propose ChatPattern, a novel Large-Language-Model (LLM) powered framework for…

计算与语言 · 计算机科学 2024-03-26 Zixiao Wang , Yunheng Shen , Xufeng Yao , Wenqian Zhao , Yang Bai , Farzan Farnia , Bei Yu

Large language models (LLMs) provide a new way to build chatbots by accepting natural language prompts. Yet, it is unclear how to design prompts to power chatbots to carry on naturalistic conversations while pursuing a given goal, such as…

人机交互 · 计算机科学 2024-05-08 Jing Wei , Sungdong Kim , Hyunhoon Jung , Young-Ho Kim

The incorporation of Artificial Intelligence (AI) models into various optimization systems is on the rise. Yet, addressing complex urban and environmental management problems normally requires in-depth domain science and informatics…

人工智能 · 计算机科学 2024-09-10 Jose Tupayachi , Haowen Xu , Olufemi A. Omitaomu , Mustafa Can Camur , Aliza Sharmin , Xueping Li

AI tasks encompass a wide range of domains and fields. While numerous AI models have been designed for specific tasks and applications, they often require considerable human efforts in finding the right model architecture, optimization…

计算与语言 · 计算机科学 2023-05-05 Shujian Zhang , Chengyue Gong , Lemeng Wu , Xingchao Liu , Mingyuan Zhou

Internet of Things (IoT) has gained widespread popularity, revolutionizing industries and daily life. However, it has also emerged as a prime target for attacks. Numerous efforts have been made to improve IoT security, and substantial IoT…

密码学与安全 · 计算机科学 2026-01-12 Ye Dong , Yan Lin Aung , Sudipta Chattopadhyay , Jianying Zhou

This paper introduces ChatbotManip, a novel dataset for studying manipulation in Chatbots. It contains simulated generated conversations between a chatbot and a (simulated) user, where the chatbot is explicitly asked to showcase…

计算与语言 · 计算机科学 2026-05-12 Jack Contro , Simrat Deol , Yulan He , Martim Brandão
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