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Large Language Models (LLMs) are increasingly deployed to autonomously solve real-world tasks. A key ingredient for this is the LLM Function-Calling paradigm, a widely used approach for equipping LLMs with tool-use capabilities. However, an…

Computation and Language · Computer Science 2026-04-28 Zihuiwen Ye , Lukas Aichberger , Michael Kirchhof , Sinead Williamson , Luca Zappella , Yarin Gal , Arno Blaas , Adam Golinski

The rapid advancement of Large Language Models (LLMs) poses a significant challenge to existing mathematical reasoning benchmarks. However, these benchmarks tend to become easier over time as LLMs can learn from the published benchmarks.…

Artificial Intelligence · Computer Science 2025-10-07 Shengbo Wang , Mingwei Liu , Zike Li , Anji Li , Yanlin Wang , Xin Peng , Zibin Zheng

Heuristic design with large language models (LLMs) has emerged as a promising approach for tackling combinatorial optimization problems (COPs). However, existing approaches often rely on manually predefined evolutionary computation (EC)…

Machine Learning · Computer Science 2026-03-25 Yiding Shi , Jianan Zhou , Wen Song , Jieyi Bi , Yaoxin Wu , Zhiguang Cao , Jie Zhang

As Noisy Intermediate-Scale Quantum (NISQ) devices grow in number of qubits, determining good or even adequate parameter configurations for a given application, or for device calibration, becomes a cumbersome task. An evolutionary algorithm…

Quantum Physics · Physics 2021-07-15 Luke Mortimer , Marta P. Estarellas , Timothy P. Spiller , Irene D'Amico

We introduce CodeEvolve, an open-source framework that couples large language models with island-based evolutionary search for end-to-end algorithmic discovery. CodeEvolve integrates inspiration-based crossover, meta-prompting, and…

Artificial Intelligence · Computer Science 2026-05-29 Henrique Assumpção , Diego Ferreira , Leandro Campos , Fabricio Murai

Uncertainty Quantification (UQ) for Natural Language Generation (NLG) is crucial for assessing the performance of Large Language Models (LLMs), as it reveals confidence in predictions, identifies failure modes, and gauges output…

Computation and Language · Computer Science 2025-04-09 Sean Wang , Yicheng Jiang , Yuxin Tang , Lu Cheng , Hanjie Chen

The ability to replicate predictions by machine learning (ML) or artificial intelligence (AI) models and results in scientific workflows that incorporate such ML/AI predictions is driven by numerous factors. An uncertainty-aware metric that…

Machine Learning · Computer Science 2023-08-28 Line Pouchard , Kristofer G. Reyes , Francis J. Alexander , Byung-Jun Yoon

Hallucinations are a common issue that undermine the reliability of large language models (LLMs). Recent studies have identified a specific subset of hallucinations, known as confabulations, which arise due to predictive uncertainty of…

Machine Learning · Computer Science 2025-10-24 Mykyta Ielanskyi , Kajetan Schweighofer , Lukas Aichberger , Sepp Hochreiter

We consider the problem of quantifying uncertainty over expected cumulative rewards in model-based reinforcement learning. In particular, we focus on characterizing the variance over values induced by a distribution over Markov decision…

Machine Learning · Computer Science 2024-09-18 Carlos E. Luis , Alessandro G. Bottero , Julia Vinogradska , Felix Berkenkamp , Jan Peters

Algorithm design and analysis is a cornerstone of computer science, but it confronts a major challenge. Proving an algorithm's performance guarantee across all inputs has traditionally required extensive and often error-prone human effort.…

Computer Science and Game Theory · Computer Science 2025-08-19 Hanyu Li , Dongchen Li , Xiaotie Deng

Uncertainty quantification (UQ) is important for reliability assessment and enhancement of machine learning models. In deep learning, uncertainties arise not only from data, but also from the training procedure that often injects…

Machine Learning · Statistics 2023-11-13 Ziyi Huang , Henry Lam , Haofeng Zhang

Supervised fine-tuning is a standard method for adapting pre-trained large language models (LLMs) to downstream tasks. Quantization has been recently studied as a post-training technique for efficient LLM deployment. To obtain quantized…

Machine Learning · Computer Science 2025-06-09 Quan Wei , Chung-Yiu Yau , Hoi-To Wai , Yang Katie Zhao , Dongyeop Kang , Youngsuk Park , Mingyi Hong

Large Language Models (LLMs) have been transformative across many domains. However, hallucination, i.e., confidently outputting incorrect information, remains one of the leading challenges for LLMs. This raises the question of how to…

Computation and Language · Computer Science 2026-03-19 Toghrul Abbasli , Kentaroh Toyoda , Yuan Wang , Leon Witt , Muhammad Asif Ali , Yukai Miao , Dan Li , Qingsong Wei

Large Language Models (LLMs) have advanced Automated Heuristic Design (AHD) in combinatorial optimization (CO) in the past few years. However, existing discovery pipelines often require extensive manual trial-and-error or reliance on domain…

Neural and Evolutionary Computing · Computer Science 2026-02-19 Mingxin Yu , Ruixiao Yang , Chuchu Fan

We use Quantum Imaginary Time Evolution (QITE) to solve polynomial unconstrained binary optimization (PUBO) problems. We show that a linear Ansatz yields good results for a wide range of PUBO problems, often outperforming standard classical…

Quantum Physics · Physics 2023-12-29 Nora M. Bauer , Rizwanul Alam , James Ostrowski , George Siopsis

As fully fault-tolerant quantum computers capable of solving useful problems remain a distant goal, we anticipate an era of "early fault tolerance" where limited error correction is available. We propose a framework for designing early…

We consider enhancing large language models (LLMs) for complex planning tasks. While existing methods allow LLMs to explore intermediate steps to make plans, they either depend on unreliable self-verification or external verifiers to…

Artificial Intelligence · Computer Science 2025-02-27 Hongyi Ling , Shubham Parashar , Sambhav Khurana , Blake Olson , Anwesha Basu , Gaurangi Sinha , Zhengzhong Tu , James Caverlee , Shuiwang Ji

Hybrid optimization algorithms have gained popularity as it has become apparent there cannot be a universal optimization strategy which is globally more beneficial than any other. Despite their popularity, hybridization frameworks require…

Neural and Evolutionary Computing · Computer Science 2013-03-15 Hassan A. Bashir , Richard S. Neville

We study the current state of the Quantum Software Engineering (QSE) ecosystem, focusing on the achievements, activities, and engagements from academia and industry, with a special focus on successful entrepreneurial endeavors in this…

Software Engineering · Computer Science 2026-01-07 Nazanin Siavash , Armin Moin

Quantization is a proven effective method for compressing large language models. Although popular techniques like W8A8 and W4A16 effectively maintain model performance, they often fail to concurrently speed up the prefill and decoding…

Machine Learning · Computer Science 2024-08-01 Ying Zhang , Peng Zhang , Mincong Huang , Jingyang Xiang , Yujie Wang , Chao Wang , Yineng Zhang , Lei Yu , Chuan Liu , Wei Lin
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