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We present Chain of Simulation (CoS), a novel dual-mode reasoning framework that dynamically routes problems to specialized reasoning strategies in Large Language Models (LLMs). Unlike existing uniform prompting approaches, CoS employs…

Artificial Intelligence · Computer Science 2026-02-04 Saeid Sheikhi

Large Language Models (LLMs) have achieved remarkable success in source code understanding, yet as software systems grow in scale, computational efficiency has become a critical bottleneck. Currently, these models rely on a text-based…

Computation and Language · Computer Science 2026-04-29 Yuling Shi , Chaoxiang Xie , Zhensu Sun , Yeheng Chen , Chenxu Zhang , Longfei Yun , Chengcheng Wan , Hongyu Zhang , David Lo , Xiaodong Gu

Chain-of-thought (CoT), tree-of-thought (ToT), and related techniques work surprisingly well in practice for some complex reasoning tasks with Large Language Models (LLMs), but why? This work seeks the underlying reasons by conducting…

Artificial Intelligence · Computer Science 2024-06-19 Liwei Kang , Zirui Zhao , David Hsu , Wee Sun Lee

Combinatorial optimization (CO) is essential for improving efficiency and performance in engineering applications. As complexity increases with larger problem sizes and more intricate dependencies, identifying the optimal solution become…

Computational Engineering, Finance, and Science · Computer Science 2025-10-30 Shuo Jiang , Min Xie , Jianxi Luo

In this paper, we take the initiative to investigate the performance of LLMs on complex planning tasks that require LLMs to understand a virtual spatial environment simulated via natural language and act correspondingly in text. We propose…

Computation and Language · Computer Science 2024-08-06 Hanxu Hu , Hongyuan Lu , Huajian Zhang , Yun-Ze Song , Wai Lam , Yue Zhang

This paper investigates the capabilities of large language models (LLMs) in formulating and solving decision-making problems using mathematical programming. We first conduct a systematic review and meta-analysis of recent literature to…

Artificial Intelligence · Computer Science 2025-08-26 Mohammad J. Abdel-Rahman , Yasmeen Alslman , Dania Refai , Amro Saleh , Malik A. Abu Loha , Mohammad Yahya Hamed

Large Language Models (LLMs) exhibit remarkable generative capabilities, enabling the generation of valuable information. Despite these advancements, previous research found that LLMs sometimes struggle with adhering to specific constraints…

Artificial Intelligence · Computer Science 2024-02-27 Kaiwen Wei , Jingyuan Zhang , Hongzhi Zhang , Fuzheng Zhang , Di Zhang , Li Jin , Yue Yu

Executing computer programs described in natural language has long been a pursuit of computer science. With the advent of enhanced natural language understanding capabilities exhibited by large language models (LLMs), the path toward this…

Computation and Language · Computer Science 2024-03-15 Xin Zheng , Qiming Zhu , Hongyu Lin , Yaojie Lu , Xianpei Han , Le Sun

Large Language Models (LLMs) are unable to reliably reason about specific physical systems. Attempts to imbue LLMs with knowledge of the necessary physics concepts have shown great promise, but explainability and validation remain open…

Artificial Intelligence · Computer Science 2026-05-22 Sean Memery , Kartic Subr

With the rapid advancement of Large Language Models (LLMs), the demand for robust instruction-following capabilities in code generation tasks has grown significantly. Code generation not only facilitates faster prototyping and automated…

Software Engineering · Computer Science 2025-08-05 Kaiwen Yan , Hongcheng Guo , Xuanqing Shi , Shaosheng Cao , Donglin Di , Zhoujun Li

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

Chain-of-Thought (CoT) prompting can dramatically improve the multi-step reasoning abilities of large language models (LLMs). CoT explicitly encourages the LLM to generate intermediate rationales for solving a problem, by providing a series…

Computation and Language · Computer Science 2023-06-02 Boshi Wang , Sewon Min , Xiang Deng , Jiaming Shen , You Wu , Luke Zettlemoyer , Huan Sun

Large Language Models (LLMs) have become extremely potent instruments with exceptional capacities for comprehending and producing human-like text in a wide range of applications. However, the increasing size and complexity of LLMs present…

Machine Learning · Computer Science 2024-06-18 Yingbing Huang , Lily Jiaxin Wan , Hanchen Ye , Manvi Jha , Jinghua Wang , Yuhong Li , Xiaofan Zhang , Deming Chen

Large Language Models (LLMs) have shown remarkable performance in various natural language processing tasks but face challenges in mathematical reasoning, where complex problem-solving requires both linguistic understanding and mathematical…

Computation and Language · Computer Science 2025-03-20 Shuguang Chen , Guang Lin

In the realm of embodied artificial intelligence, the reasoning capabilities of Large Language Models (LLMs) play a pivotal role. Although there are effective methods like program-of-thought prompting for LLMs which uses programming…

Computation and Language · Computer Science 2023-12-19 Zhen Bi , Ningyu Zhang , Yinuo Jiang , Shumin Deng , Guozhou Zheng , Huajun Chen

Logical reasoning is a critical benchmark for evaluating the capabilities of large language models (LLMs), as it reflects their ability to derive valid conclusions from given premises. While the combination of test-time scaling with…

Computation and Language · Computer Science 2025-08-28 Ramya Keerthy Thatikonda , Wray Buntine , Ehsan Shareghi

We assess how the code reasoning abilities of large language models (LLMs) generalize to different kinds of programs. We present techniques for obtaining in- and out-of-distribution programs with different characteristics: code sampled from…

Software Engineering · Computer Science 2025-04-09 Rem Yang , Julian Dai , Nikos Vasilakis , Martin Rinard

Large Language Models (LLMs) have demonstrated great promise in generating code, especially when used inside an evolutionary computation framework to iteratively optimize the generated algorithms. However, in some cases they fail to…

Neural and Evolutionary Computing · Computer Science 2025-03-24 Niki van Stein , Anna V. Kononova , Lars Kotthoff , Thomas Bäck

Recent advances in test-time scaling have enabled Large Language Models (LLMs) to display sophisticated reasoning abilities via extended Chain-of-Thought (CoT) generation. Despite their potential, these Reasoning LLMs (RLMs) often…

Computation and Language · Computer Science 2025-05-21 Zhen Xiong , Yujun Cai , Zhecheng Li , Yiwei Wang

Distilling explicit chain-of-thought reasoning paths has emerged as an effective method for improving the reasoning abilities of large language models (LLMs) across various tasks. However, when tackling complex tasks that pose significant…

Computation and Language · Computer Science 2024-04-15 Jierui Li , Raymond Mooney