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Large language models (LLMs) have shown impressive performance on complex reasoning by leveraging chain-of-thought (CoT) prompting to generate intermediate reasoning chains as the rationale to infer the answer. However, existing CoT studies…

Computation and Language · Computer Science 2024-05-21 Zhuosheng Zhang , Aston Zhang , Mu Li , Hai Zhao , George Karypis , Alex Smola

Fine-tuning on task-specific question-answer pairs is a predominant method for enhancing the performance of instruction-tuned large language models (LLMs) on downstream tasks. However, in certain specialized domains, such as healthcare or…

Computation and Language · Computer Science 2024-10-18 Shuyang Jiang , Yusheng Liao , Ya Zhang , Yanfeng Wang , Yu Wang

Large language models (LLMs) exhibit strong reasoning capabilities when guided by high-quality demonstrations, yet such data is often distributed across organizations that cannot centralize it due to regulatory, proprietary, or…

Computation and Language · Computer Science 2026-05-13 Ruhan Wang , Chengkai Huang , Zhiyong Wang , Junda Wu , Rui Wang , Tong Yu , Julian McAuley , Lina Yao , Dongruo Zhou

Although large language models (LLMs) have achieved excellent performance in a variety of evaluation benchmarks, they still struggle in complex reasoning tasks which require specific knowledge and multi-hop reasoning. To improve the…

Computation and Language · Computer Science 2023-11-07 Zhipeng Chen , Kun Zhou , Beichen Zhang , Zheng Gong , Wayne Xin Zhao , Ji-Rong Wen

Multimodal Large Language Models (MLLMs) frequently suffer from unfaithfulness, generating reasoning chains that drift from visual evidence or contradict final predictions. We propose Faithful-First Reasoning, Planning, and Acting (RPA)…

Artificial Intelligence · Computer Science 2026-04-09 Junxian Li , Xinyue Xu , Sai Ma , Di Zhang , Sichao Li

Considering the significance of proteins, computational protein science has always been a critical scientific field, dedicated to revealing knowledge and developing applications within the protein sequence-structure-function paradigm. In…

Computational Engineering, Finance, and Science · Computer Science 2025-01-28 Wenqi Fan , Yi Zhou , Shijie Wang , Yuyao Yan , Hui Liu , Qian Zhao , Le Song , Qing Li

Protein language models have excelled in a variety of tasks, ranging from structure prediction to protein engineering. However, proteins are highly diverse in functions and structures, and current state-of-the-art models including the…

Biomolecules · Quantitative Biology 2023-02-27 Chang Ma , Haiteng Zhao , Lin Zheng , Jiayi Xin , Qintong Li , Lijun Wu , Zhihong Deng , Yang Lu , Qi Liu , Lingpeng Kong

Reasoning on large and complex real-world models is a computationally difficult task, yet one that is required for effective use of many AI applications. A plethora of inference algorithms have been developed that work well on specific…

Artificial Intelligence · Computer Science 2016-06-13 Avi Pfeffer , Brian Ruttenberg , William Kretschmer

Enhancing the reasoning capabilities of Large Language Models (LLMs) is a key strategy for building Agents that "think then act." However, recent observations, like OpenAI's o3, suggest a paradox: stronger reasoning often coincides with…

Machine Learning · Computer Science 2026-04-20 Chenlong Yin , Zeyang Sha , Shiwen Cui , Changhua Meng , Zechao Li

Large language models (LLMs) have revolutionized many areas (e.g. natural language processing, software engineering, etc.) by achieving state-of-the-art performance on extensive downstream tasks. Aiming to achieve robust and general…

Artificial Intelligence · Computer Science 2024-01-18 Zhiming Li , Yushi Cao , Xiufeng Xu , Junzhe Jiang , Xu Liu , Yon Shin Teo , Shang-wei Lin , Yang Liu

Reasoning is a key component of language understanding in Large Language Models. While Chain-of-Thought prompting enhances performance via explicit intermediate steps, it suffers from sufficient token overhead and a fixed reasoning…

Computation and Language · Computer Science 2025-11-18 Xinyuan Wang , Dongjie Wang , Wangyang Ying , Haoyue Bai , Nanxu Gong , Sixun Dong , Kunpeng Liu , Yanjie Fu

Robot chain-of-thought reasoning (CoT) -- wherein a model predicts helpful intermediate representations before choosing actions -- provides an effective method for improving the generalization and performance of robot policies, especially…

Robotics · Computer Science 2025-05-20 William Chen , Suneel Belkhale , Suvir Mirchandani , Oier Mees , Danny Driess , Karl Pertsch , Sergey Levine

Agentic reinforcement learning has advanced large language models (LLMs) to reason through long chain-of-thought trajectories while interleaving external tool use. Existing approaches assume a fixed inventory of tools, limiting LLM agents'…

Computation and Language · Computer Science 2025-12-16 Jiaru Zou , Ling Yang , Yunzhe Qi , Sirui Chen , Mengting Ai , Ke Shen , Jingrui He , Mengdi Wang

We introduce Phi-4-reasoning, a 14-billion parameter reasoning model that achieves strong performance on complex reasoning tasks. Trained via supervised fine-tuning of Phi-4 on carefully curated set of "teachable" prompts-selected for the…

This paper deals with improving querying large language models (LLMs). It is well-known that without relevant contextual information, LLMs can provide poor quality responses or tend to hallucinate. Several initiatives have proposed…

Computation and Language · Computer Science 2025-07-14 Nripesh Niketan , Hadj Batatia

Procedural activity assistants potentially support humans in a variety of settings, from our daily lives, e.g., cooking or assembling flat-pack furniture, to professional situations, e.g., manufacturing or biological experiments. Despite…

Computation and Language · Computer Science 2025-10-02 Kimihiro Hasegawa , Wiradee Imrattanatrai , Masaki Asada , Ken Fukuda , Teruko Mitamura

Large language models (LLMs), such as LLaMA, Alpaca, Vicuna, GPT-3.5 and GPT-4, have advanced the performance of AI systems on various natural language processing tasks to human-like levels. However, their generalisation and robustness when…

Computation and Language · Computer Science 2025-01-20 Qiming Bao , Gael Gendron , Alex Yuxuan Peng , Wanjun Zhong , Neset Tan , Yang Chen , Michael Witbrock , Jiamou Liu

Large Language Models (LLMs) have shown remarkable capabilities in reasoning, exemplified by the success of OpenAI-o1 and DeepSeek-R1. However, integrating reasoning with external search processes remains challenging, especially for complex…

In recent years, large pretrained models have been used in dialogue systems to improve successful task completion rates. However, lack of reasoning capabilities of dialogue platforms make it difficult to provide relevant and fluent…

Computation and Language · Computer Science 2022-02-10 Sajjad Beygi , Maryam Fazel-Zarandi , Alessandra Cervone , Prakash Krishnan , Siddhartha Reddy Jonnalagadda

Building a working mental model of a protein typically requires weeks of reading, cross-referencing crystal and predicted structures, and inspecting ligand complexes, an effort that is slow, unevenly accessible, and often requires…

Biomolecules · Quantitative Biology 2025-10-22 Carles Navarro , Mariona Torrens , Philipp Thölke , Stefan Doerr , Gianni De Fabritiis