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Fine-tuning Large Language Models (LLMs) has proven effective for a variety of downstream tasks. However, as LLMs grow in size, the memory demands for backpropagation become increasingly prohibitive. Zeroth-order (ZO) optimization methods…

Machine Learning · Computer Science 2025-07-25 Ziming Yu , Pan Zhou , Sike Wang , Jia Li , Mi Tian , Hua Huang

Diffusion Language Models (DLMs) offer order-agnostic generation that can explore many possible decoding trajectories. However, current decoding methods commit to a single trajectory, limiting exploration in trajectory space. We introduce…

Computation and Language · Computer Science 2026-02-06 Yangyi Shen , Tianjian Feng , Jiaqi Han , Wen Wang , Tianlang Chen , Chunhua Shen , Jure Leskovec , Stefano Ermon

Bayesian optimization over the latent spaces of deep autoencoder models (DAEs) has recently emerged as a promising new approach for optimizing challenging black-box functions over structured, discrete, hard-to-enumerate search spaces (e.g.,…

Machine Learning · Computer Science 2023-02-24 Natalie Maus , Haydn T. Jones , Juston S. Moore , Matt J. Kusner , John Bradshaw , Jacob R. Gardner

Searching large and complex design spaces for a global optimum can be infeasible and unnecessary. A practical alternative is to iteratively refine the neighborhood of an initial design using local optimization methods such as gradient…

Machine Learning · Computer Science 2025-11-25 David Stenger , Armin Lindicke , Alexander von Rohr , Sebastian Trimpe

Fine-tuning large language models (LLMs) for recommendation in a generative manner has delivered promising results, but encounters significant inference overhead due to autoregressive decoding in the language space. This work explores…

Information Retrieval · Computer Science 2025-09-16 Chengbing Wang , Yang Zhang , Zhicheng Wang , Tianhao Shi , Keqin Bao , Fuli Feng , Tat-Seng Chua

The efficacy of large language models (LLMs) in understanding and generating natural language has aroused a wide interest in developing prompt-based methods to harness the power of black-box LLMs. Existing methodologies usually prioritize a…

Artificial Intelligence · Computer Science 2024-03-06 Wenyang Hu , Yao Shu , Zongmin Yu , Zhaoxuan Wu , Xiangqiang Lin , Zhongxiang Dai , See-Kiong Ng , Bryan Kian Hsiang Low

The integration of Large Language Models (LLMs) into evolutionary frameworks has established a new paradigm for automated heuristic discovery. Despite their promise, these methods typically search in the discrete space of program syntax,…

Artificial Intelligence · Computer Science 2026-05-19 Cheikh Ahmed , Mahdi Mostajabdaveh , Zirui Zhou

We frame code generation as a black-box optimization problem within the code space and demonstrate how optimization-inspired techniques can enhance inference scaling. Based on this perspective, we propose SCATTERED FOREST SEARCH (SFS), a…

Software Engineering · Computer Science 2025-02-26 Jonathan Light , Yue Wu , Yiyou Sun , Wenchao Yu , Yanchi liu , Xujiang Zhao , Ziniu Hu , Haifeng Chen , Wei Cheng

Segmentation based on language has been a popular topic in computer vision. While recent advances in multimodal large language models (MLLMs) have endowed segmentation systems with reasoning capabilities, these efforts remain confined by…

Computer Vision and Pattern Recognition · Computer Science 2026-02-05 Tianming Liang , Qirui Du , Jian-Fang Hu , Haichao Jiang , Zicheng Lin , Wei-Shi Zheng

Large Language Models (LLMs) are increasingly being integrated into various components of Ontology Matching pipelines. This paper investigates the capability of LLMs to perform ontology matching directly on ontology modules and generate the…

Computation and Language · Computer Science 2025-12-01 Guilherme Sousa , Rinaldo Lima , Cassia Trojahn

Molecular discovery, when formulated as an optimization problem, presents significant computational challenges because optimization objectives can be non-differentiable. Evolutionary Algorithms (EAs), often used to optimize black-box…

Bayesian Optimization (BO) has been widely used to efficiently optimize expensive black-box functions with limited evaluations. In this paper, we investigate the use of BO for prompt engineering to enhance text classification with Large…

Artificial Intelligence · Computer Science 2025-10-17 Adam Ballew , Jingbo Wang , Shaogang Ren

Large Language Models (LLMs) have recently emerged as effective surrogate models and candidate generators within global optimization frameworks for expensive blackbox functions. Despite promising results, LLM-based methods often struggle in…

Machine Learning · Computer Science 2026-01-28 Andrej Schwanke , Lyubomir Ivanov , David Salinas , Fabio Ferreira , Aaron Klein , Frank Hutter , Arber Zela

Transformers have a quadratic scaling of computational complexity with input size, which limits the input context window size of large language models (LLMs) in both training and inference. Meanwhile, retrieval-augmented generation (RAG)…

Computation and Language · Computer Science 2024-10-18 Yimin Tang , Yurong Xu , Ning Yan , Masood Mortazavi

LLM discovery and optimization systems are increasingly applied across domains, implementing a common propose-evaluate-revise loop. Such optimization or discovery progresses via context conditioning on received feedback from an environment.…

Artificial Intelligence · Computer Science 2026-05-20 Dmitry Redko , Albert Fazlyev , Konstantin Sozykin , Maria Ivanova , Evgeny Burnaev , Egor Shvetsov

Recently, test-time scaling has garnered significant attention from the research community, largely due to the substantial advancements of the o1 model released by OpenAI. By allocating more computational resources during the inference…

In multi-task Bayesian optimization, the goal is to leverage experience from optimizing existing tasks to improve the efficiency of optimizing new ones. While approaches using multi-task Gaussian processes or deep kernel transfer exist, the…

Large language models (LLMs) have demonstrated significant potential in code generation tasks. However, there remains a performance gap between open-source and closed-source models. To address this gap, existing approaches typically…

Computation and Language · Computer Science 2025-04-18 Weijie Lv , Xuan Xia , Sheng-Jun Huang

With the advent of large language models (LLMs), there has been a great deal of interest in applying them to solve difficult programming tasks. Recent work has demonstrated their potential at program optimization, a key challenge in…

Machine Learning · Computer Science 2025-02-03 Sagnik Anupam , Alexander Shypula , Osbert Bastani

LLMs have fundamentally transformed dense retrieval, upgrading backbones from discriminative encoders to generative architectures. However, a critical disconnect remains: while LLMs possess strong reasoning capabilities, current retrievers…

Computation and Language · Computer Science 2026-03-03 Jiajie Jin , Yanzhao Zhang , Mingxin Li , Dingkun Long , Pengjun Xie , Yutao Zhu , Zhicheng Dou
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