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We present AMO-Bench, an Advanced Mathematical reasoning benchmark with Olympiad level or even higher difficulty, comprising 50 human-crafted problems. Existing benchmarks have widely leveraged high school math competitions for evaluating…

Computation and Language · Computer Science 2025-10-31 Shengnan An , Xunliang Cai , Xuezhi Cao , Xiaoyu Li , Yehao Lin , Junlin Liu , Xinxuan Lv , Dan Ma , Xuanlin Wang , Ziwen Wang , Shuang Zhou

Large Language Models (LLMs) have the potential to accelerate small molecule drug design due to their ability to reason about information from diverse sources and formats. However, their practical utility remains unclear due to the lack of…

The synthesis of inorganic crystalline materials is essential for modern technology, especially in quantum materials development. However, designing efficient synthesis workflows remains a significant challenge due to the precise…

DevBench is a telemetry-driven benchmark designed to evaluate Large Language Models (LLMs) on realistic code completion tasks. It includes 1,800 evaluation instances across six programming languages and six task categories derived from real…

Machine Learning · Computer Science 2026-05-19 Adarsh Kumarappan , Pareesa Ameneh Golnari , Wen Wen , Xiaoyu Liu , Gabriel Ryan , Yuting Sun , Shengyu Fu , Elsie Nallipogu

Recent advancements in large language models (LLMs) have significantly enhanced text generation capabilities, yet evaluating their performance in generative writing remains a challenge. Existing benchmarks primarily focus on generic text…

Artificial Intelligence · Computer Science 2025-12-01 Yuning Wu , Jiahao Mei , Ming Yan , Chenliang Li , Shaopeng Lai , Yuran Ren , Zijia Wang , Ji Zhang , Mengyue Wu , Qin Jin , Fei Huang

Large language model (LLM) agents have demonstrated remarkable potential in advancing scientific discovery. However, their capability in the fundamental yet crucial task of reproducing code from research papers, especially in the NLP…

Large language models have demonstrated strong performance on general-purpose programming tasks, yet their ability to generate executable algorithmic trading strategies remains underexplored. Unlike standard code benchmarks,…

Computation and Language · Computer Science 2026-04-17 Alexey Khoroshilov , Alexey Chernysh , Orkhan Ekhtibarov , Nini Kamkia , Dmitry Zmitrovich

The ability to understand causality significantly impacts the competence of large language models (LLMs) in output explanation and counterfactual reasoning, as causality reveals the underlying data distribution. However, the lack of a…

Machine Learning · Computer Science 2024-09-30 Yu Zhou , Xingyu Wu , Beicheng Huang , Jibin Wu , Liang Feng , Kay Chen Tan

Quickly resolving issues reported in industrial applications is crucial to minimize economic impact. However, the required data analysis makes diagnosing the underlying root causes a challenging and time-consuming task, even for experts. In…

Computation and Language · Computer Science 2024-10-15 Jordis Emilia Herrmann , Aswath Mandakath Gopinath , Mikael Norrlof , Mark Niklas Müller

We introduce a new molecular dataset, named Alchemy, for developing machine learning models useful in chemistry and material science. As of June 20th 2019, the dataset comprises of 12 quantum mechanical properties of 119,487 organic…

Large Language Models (LLMs) have demonstrated exceptional performance in general knowledge and reasoning tasks across various domains. However, their effectiveness in specialized scientific fields like Chemical and Biological Engineering…

Artificial Intelligence · Computer Science 2025-05-20 Gaurab Sarkar , Sougata Saha

Science and engineering problems fall in the category of complex conceptual problems that require specific conceptual information (CI) like math/logic -related know-how, process information, or engineering guidelines to solve them. Large…

Computation and Language · Computer Science 2024-12-23 Nishtha N. Vaidya , Thomas Runkler , Thomas Hubauer , Veronika Haderlein-Hoegberg , Maja Mlicic Brandt

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…

While Large Language Models (LLMs) achieve near-human performance on standard benchmarks, their capabilities often fail to generalize to complex, real-world problems. To bridge this gap, we introduce DeepQuestion, a scalable, automated…

Computation and Language · Computer Science 2026-03-02 Ali Khoramfar , Ali Ramezani , Mohammad Mahdi Mohajeri , Mohammad Javad Dousti , Majid Nili Ahmadabadi , Heshaam Faili

Large language models (LLMs) are increasingly applied to materials science questions, including literature comprehension, property prediction, materials discovery and alloy design. At the same time, a wide range of physics-based…

Materials Science · Physics 2025-12-17 Siyu Liu , Bo Hu , Beilin Ye , Jiamin Xu , David J. Srolovitz , Tongqi Wen

The use of large language models (LLMs) for qualitative analysis is gaining attention in various fields, including software engineering, where qualitative methods are essential for understanding human and social factors. This study aimed to…

Software Engineering · Computer Science 2025-03-11 Matheus de Morais Leça , Lucas Valença , Reydne Santos , Ronnie de Souza Santos

Large Language Models (LLMs) have achieved impressive results across a broad array of tasks, yet their capacity for complex, domain-specific mathematical reasoning-particularly in wireless communications-remains underexplored. In this work,…

Computation and Language · Computer Science 2025-05-21 Xin Li , Mengbing Liu , Li Wei , Jiancheng An , Mérouane Debbah , Chau Yuen

Quantum Computing (QC) claims to improve the efficiency of solving complex problems, compared to classical computing. When QC is integrated with Machine Learning (ML), it creates a Quantum Machine Learning (QML) system. This paper aims to…

Quantum Physics · Physics 2025-06-11 Kamila Zaman , Alberto Marchisio , Muhammad Abdullah Hanif , Muhammad Shafique

Large language models (LLMs) offer new opportunities for automated data extraction and property prediction across materials science, yet their use in superconductivity research remains limited. Here we construct a large experimental…

Materials Science · Physics 2025-12-12 Suman Itani , Yibo Zhang , Ranjit Itani , Jiadong Zang
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