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In recent years, Large Language Models (LLMs) have made significant strides towards Artificial General Intelligence. However, training these models from scratch requires substantial computational resources and vast amounts of text data. In…

计算与语言 · 计算机科学 2024-10-03 Wenzhen Zheng , Wenbo Pan , Xu Xu , Libo Qin , Li Yue , Ming Zhou

Large Language Models (LLMs) specializing in code generation (which are also often referred to as code LLMs), e.g., StarCoder and Code Llama, play increasingly critical roles in various software development scenarios. It is also crucial for…

In computational biophysics, where molecular data is expanding rapidly and system complexity is increasing exponentially, large language models (LLMs) and agent-based systems are fundamentally reshaping the field. This perspective article…

Large language models (LLMs) have ushered in a new era for processing complex information in various fields, including science. The increasing amount of scientific literature allows these models to acquire and understand scientific…

计算与语言 · 计算机科学 2024-08-21 Huy Quoc To , Ming Liu , Guangyan Huang

Large Language Models (LLMs), such as ChatGPT, LLaMA, GLM, and PaLM, have exhibited remarkable performances across various tasks in recent years. However, LLMs face two main challenges in real-world applications. One challenge is that…

机器学习 · 计算机科学 2023-10-17 Tao Fan , Yan Kang , Guoqiang Ma , Weijing Chen , Wenbin Wei , Lixin Fan , Qiang Yang

The promise of data-driven materials discovery remains constrained by the scarcity of large, high-quality, and accessible experimental datasets. Here, we introduce a generalizable large language model (LLM)-powered pipeline for automated…

材料科学 · 物理学 2026-04-28 Zhanzhao Li , Kengran Yang , Qiyao He , Kai Gong

Large Language Models (LLMs) prompted to generate chain-of-thought (CoT) exhibit impressive reasoning capabilities. Recent attempts at prompt decomposition toward solving complex, multi-step reasoning problems depend on the ability of the…

计算与语言 · 计算机科学 2024-02-28 Gurusha Juneja , Subhabrata Dutta , Soumen Chakrabarti , Sunny Manchanda , Tanmoy Chakraborty

Advancements in large language models (LLMs) have demonstrated their potential in facilitating high-level reasoning, logical reasoning and robotics planning. Recently, LLMs have also been able to generate reward functions for low-level…

机器人学 · 计算机科学 2024-02-21 Marta Skreta , Zihan Zhou , Jia Lin Yuan , Kourosh Darvish , Alán Aspuru-Guzik , Animesh Garg

Traditional quantitative investment research is encountering diminishing returns alongside rising labor and time costs. To overcome these challenges, we introduce the Large Investment Model (LIM), a novel research paradigm designed to…

统计金融 · 定量金融 2024-08-23 Jian Guo , Heung-Yeung Shum

We propose fine-tuning large language models for generation of stable materials. While unorthodox, fine-tuning large language models on text-encoded atomistic data is simple to implement yet reliable, with around 90% of sampled structures…

Machine learning potentials (MLPs) developed from extensive datasets constructed from density functional theory (DFT) calculations have become increasingly appealing for many researchers. This paper presents a framework of polynomial-based…

材料科学 · 物理学 2022-09-29 Atsuto Seko

Crafting effective features is a crucial yet labor-intensive and domain-specific task within machine learning pipelines. Fortunately, recent advancements in Large Language Models (LLMs) have shown promise in automating various data science…

计算与语言 · 计算机科学 2024-10-18 Yanlin Zhang , Ning Li , Quan Gan , Weinan Zhang , David Wipf , Minjie Wang

Neural networks are increasingly used to support decision-making. To verify their reliability and adaptability, researchers and practitioners have proposed a variety of tools and methods for tasks such as NN code verification, refactoring,…

机器学习 · 计算机科学 2026-02-05 Nadia Daoudi , Jordi Cabot

Integrating large language models (LLMs) with knowledge graphs derived from domain-specific data represents an important advancement towards more powerful and factual reasoning. As these models grow more capable, it is crucial to enable…

人工智能 · 计算机科学 2024-04-19 Stefan Dernbach , Khushbu Agarwal , Alejandro Zuniga , Michael Henry , Sutanay Choudhury

Natural language processing (NLP) has grown significantly since the advent of the Transformer architecture. Transformers have given birth to pre-trained large language models (PLMs). There has been tremendous improvement in the performance…

计算与语言 · 计算机科学 2024-07-16 Jesse Atuhurra , Hidetaka Kamigaito

Ensuring the reproducibility of physics results is one of the crucial challenges in high-energy physics (HEP). In this study, we develop a proof-of-concept system that uses large language models (LLMs) to extract analysis procedures from…

数据分析、统计与概率 · 物理学 2026-04-17 Masahiko Saito , Tomoe Kishimoto , Junichi Tanaka

The rapid development of Large Language Models (LLMs) demonstrates remarkable multilingual capabilities in natural language processing, attracting global attention in both academia and industry. To mitigate potential discrimination and…

Large Language Models (LLMs) are catalyzing a paradigm shift in scientific discovery, evolving from task-specific automation tools into increasingly autonomous agents and fundamentally redefining research processes and human-AI…

计算与语言 · 计算机科学 2025-09-18 Tianshi Zheng , Zheye Deng , Hong Ting Tsang , Weiqi Wang , Jiaxin Bai , Zihao Wang , Yangqiu Song

The rising prevalence of eye diseases poses a growing public health burden. Large language models (LLMs) offer a promising path to reduce documentation workload and support clinical decision-making. However, few have been tailored for…

Large Language Models (LLMs) have emerged as a transformative power in enhancing natural language comprehension, representing a significant stride toward artificial general intelligence. The application of LLMs extends beyond conventional…