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Interactively learning from observation and language feedback is an increasingly studied area driven by the emergence of large language model (LLM) agents. While impressive empirical demonstrations have been shown, so far a principled…

Machine Learning · Computer Science 2025-06-13 Wanqiao Xu , Allen Nie , Ruijie Zheng , Aditya Modi , Adith Swaminathan , Ching-An Cheng

LLMs have made significant progress in complex but easy-to-verify problems, yet they still struggle with discovering the unknown. In this paper, we present \textbf{AlphaResearch}, an autonomous research agent designed to discover new…

Computation and Language · Computer Science 2026-04-02 Zhaojian Yu , Kaiyue Feng , Yilun Zhao , Shilin He , Xiao-Ping Zhang , Arman Cohan

In recent years, robots and autonomous systems have become increasingly integral to our daily lives, offering solutions to complex problems across various domains. Their application in search and rescue (SAR) operations, however, presents…

Robotics · Computer Science 2024-09-23 Dimitrios Panagopoulos , Adolfo Perrusquia , Weisi Guo

Large Language Model (LLM) agents have shown stunning results in complex tasks, yet they often operate in isolation, failing to learn from past experiences. Existing memory-based methods primarily store raw trajectories, which are often…

While combining large language models (LLMs) with evolutionary algorithms (EAs) shows promise for solving complex optimization problems, current approaches typically evolve individual solutions, often incurring high LLM call costs. We…

Artificial Intelligence · Computer Science 2025-08-12 Yi Zhai , Zhiqiang Wei , Ruohan Li , Keyu Pan , Shuo Liu , Lu Zhang , Jianmin Ji , Wuyang Zhang , Yu Zhang , Yanyong Zhang

Large language models (LLMs) are powerful AI tools that can generate and comprehend natural language text and other complex information. However, the field lacks a mathematical framework to systematically describe, compare and improve LLMs.…

Machine Learning · Computer Science 2023-11-07 Javier González , Aditya V. Nori

Large language models (LLMs) have demonstrated broad utility across molecular domains, spanning drug discovery and materials design. Analyzing LLMs' latent representations is crucial for elucidating their underlying mechanisms, improving…

Machine Learning · Computer Science 2026-02-03 Zhuoran Li , Xu Sun , Wanyu Lin , Jiannong Cao

Diffusion-based large language models (dLLMs) are trained flexibly to model extreme dependence in the data distribution; however, how to best utilize this information at inference time remains an open problem. In this work, we uncover an…

Information overload is a major obstacle to scientific progress. The explosive growth in scientific literature and data has made it ever harder to discover useful insights in a large mass of information. Today scientific knowledge is…

Large Language Models (LLM) have achieved remarkable performance across a large number of tasks, but face critical deployment and usage barriers due to substantial computational requirements. Model compression methods, which aim to reduce…

Computation and Language · Computer Science 2025-07-15 David Ponce , Thierry Etchegoyhen , Javier Del Ser

Large language models (LLMs) excel at many supervised tasks but often struggle with structured reasoning in unfamiliar settings. This discrepancy suggests that standard fine-tuning pipelines may instill narrow, domain-specific heuristics…

Machine Learning · Computer Science 2025-06-06 Zhen Hao Wong , Jingwen Deng , Runming He , Zirong Chen , Qijie You , Hejun Dong , Hao Liang , Chengyu Shen , Bin Cui , Wentao Zhang

Reinforcement learning (RL) with large language models shows promise in complex reasoning. However, its progress is hindered by the lack of large-scale training data that is sufficiently challenging, contamination-free and verifiable. To…

The omnipresence of NP-hard combinatorial optimization problems (COPs) compels domain experts to engage in trial-and-error heuristic design. The long-standing endeavor of design automation has gained new momentum with the rise of large…

Neural and Evolutionary Computing · Computer Science 2024-10-15 Haoran Ye , Jiarui Wang , Zhiguang Cao , Federico Berto , Chuanbo Hua , Haeyeon Kim , Jinkyoo Park , Guojie Song

Large Language Models (LLMs) demonstrate ever-increasing abilities in mathematical and algorithmic tasks, yet their geometric reasoning skills are underexplored. We investigate LLMs' abilities in constructive geometric problem-solving one…

Computation and Language · Computer Science 2024-09-23 Spyridon Mouselinos , Henryk Michalewski , Mateusz Malinowski

Transformers have demonstrated exceptional in-context learning (ICL) capabilities, enabling applications across natural language processing, computer vision, and sequential decision-making. In reinforcement learning, ICL reframes learning…

Machine Learning · Computer Science 2025-11-14 Oliver Dippel , Alexei Lisitsa , Bei Peng

Recent studies have suggested that Large Language Models (LLMs) could provide interesting ideas contributing to mathematical discovery. This claim was motivated by reports that LLM-based genetic algorithms produced heuristics offering new…

Artificial Intelligence · Computer Science 2025-11-03 Julien Herrmann , Guillaume Pallez

The integration of Large Language Models (LLMs) into recommendation systems has introduced unprecedented capabilities for natural language understanding, explanation generation, and conversational interactions. However, existing evaluation…

Information Retrieval · Computer Science 2026-01-28 Sushant Mehta

Recent advancements in reasoning-focused language models such as OpenAI's O1 and DeepSeek-R1 have shown that scaling test-time computation-through chain-of-thought reasoning and iterative exploration-can yield substantial improvements on…

This paper presents an evaluation framework for assessing Large Language Models' (LLMs) capabilities in combinatorial optimization, specifically addressing the 2D bin-packing problem. We introduce a systematic methodology that combines LLMs…

Artificial Intelligence · Computer Science 2025-10-03 Syed Mahbubul Huq , Daniel Brito , Daniel Sikar , Chris Child , Tillman Weyde , Rajesh Mojumder

Large Language Model (LLM) agents can leverage multiple turns and tools to solve complex tasks, with prompt-based approaches achieving strong performance. This work demonstrates that Reinforcement Learning (RL) can push capabilities…

Computation and Language · Computer Science 2025-10-29 Vivek Kalyan , Martin Andrews