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The ever-increasing demands of computationally expensive and high-dimensional problems require novel optimization methods to find near-optimal solutions in a reasonable amount of time. Bayesian Optimization (BO) stands as one of the best…

Neural and Evolutionary Computing · Computer Science 2023-05-19 Shay Snyder , Sumedh R. Risbud , Maryam Parsa

We present an analysis on optimizing performance of a single C++11 source code using the Alpaka hardware abstraction library. For this we use the general matrix multiplication (GEMM) algorithm in order to show that compilers can optimize…

Distributed, Parallel, and Cluster Computing · Computer Science 2018-06-12 Alexander Matthes , René Widera , Erik Zenker , Benjamin Worpitz , Axel Huebl , Michael Bussmann

Evolutionary algorithms (EAs) have achieved remarkable success in tackling complex combinatorial optimization problems. However, EAs often demand carefully-designed operators with the aid of domain expertise to achieve satisfactory…

Neural and Evolutionary Computing · Computer Science 2024-04-29 Shengcai Liu , Caishun Chen , Xinghua Qu , Ke Tang , Yew-Soon Ong

A body of work has been done to automate machine learning algorithm to highlight the importance of model choice. Automating the process of choosing the best forecasting model and its corresponding parameters can result to improve a wide…

Machine Learning · Computer Science 2021-09-02 Nadhir Hassen , Irina Rish

Evolutionary Algorithms (EAs) have become the most popular tool for solving widely-existed multi-objective optimization problems. In Multi-Objective EAs (MOEAs), there is increasing interest in using an archive to store non-dominated…

Neural and Evolutionary Computing · Computer Science 2025-12-10 Shengjie Ren , Zimin Liang , Miqing Li , Chao Qian

It is commonly believed that Bayesian optimization (BO) algorithms are highly efficient for optimizing numerically costly functions. However, BO is not often compared to widely different alternatives, and is mostly tested on narrow sets of…

Optimization and Control · Mathematics 2021-10-01 Rodolphe Le Riche , Victor Picheny

Bayesian optimization (BO) is a powerful technology for optimizing noisy expensive-to-evaluate black-box functions, with a broad range of real-world applications in science, engineering, economics, manufacturing, and beyond. In this paper,…

Machine Learning · Computer Science 2024-01-30 Joel A. Paulson , Calvin Tsay

Bayesian Optimization (BO) is a class of black-box, surrogate-based heuristics that can efficiently optimize problems that are expensive to evaluate, and hence admit only small evaluation budgets. BO is particularly popular for solving…

Machine Learning · Computer Science 2024-06-25 Maria Laura Santoni , Elena Raponi , Renato De Leone , Carola Doerr

A variety of optimization algorithms have been developed to solve engineering design problems in which the solution space is too large to manually determine the optimal solution. The Modular Optimization Framework (MOF) was developed to…

Neural and Evolutionary Computing · Computer Science 2022-04-04 Brian Andersen , Gregory Delipei , David Kropaczek , Jason Hou

The Quantum Approximate Optimization Algorithm (QAOA) is among leading candidates for achieving quantum advantage on near-term processors. While typically implemented with a transverse-field mixer (XM-QAOA), the Grover-mixer variant…

Quantum Physics · Physics 2026-01-01 Evgeniy O. Kiktenko , Elizaveta V. Krendeleva , Aleksey K. Fedorov

The Grey Wolf Optimizer (GWO) is recognized as a novel meta-heuristic algorithm inspired by the social leadership hierarchy and hunting mechanism of grey wolves. It is well-known for its simple parameter setting, fast convergence speed, and…

Neural and Evolutionary Computing · Computer Science 2024-04-11 Jianhua Jiang , Ziying Zhao , Weihua Li , Keqin Li

Designing novel proteins with desired characteristics remains a significant challenge due to the large sequence space and the complexity of sequence-function relationships. Efficient exploration of this space to identify sequences that meet…

Machine Learning · Computer Science 2026-03-04 Erik Hartman , Di Tang , Johan Malmström

Bayesian optimization (BO ) is an effective method for optimizing expensive-to-evaluate black-box functions. While high-dimensional problems can be particularly challenging, due to the multitude of parameter choices and the potentially high…

Machine Learning · Computer Science 2025-04-09 Erik Hellsten , Carl Hvarfner , Leonard Papenmeier , Luigi Nardi

Designing modern industrial systems requires balancing several competing objectives, such as profitability, resilience, and sustainability, while accounting for complex interactions between technological, economic, and environmental…

Machine Learning · Statistics 2026-02-12 Akshay Kudva , Wei-Ting Tang , Joel A. Paulson

There are a large number of optimization problems in physical models where the relationships between model parameters and outputs are unknown or hard to track. These models are named as black-box models in general because they can only be…

Machine Learning · Computer Science 2021-04-07 Zhongkai Shangguan , Lei Lin , Wencheng Wu , Beilei Xu

This paper introduces a modular framework for Mixed-variable and Combinatorial Bayesian Optimization (MCBO) to address the lack of systematic benchmarking and standardized evaluation in the field. Current MCBO papers often introduce…

Machine Learning · Computer Science 2023-12-12 Kamil Dreczkowski , Antoine Grosnit , Haitham Bou Ammar

Automated algorithm selection for continuous black-box optimization depends on representing problem information under limited probing and selecting solvers under heavy-tailed performance distributions. This paper proposes a geometric…

Machine Learning · Computer Science 2026-05-22 Jiabao Brad Wang , Xiang Shi , Yiliang Yuan , Mustafa Misir

Model merging has emerged as a cost-effective alternative to training large language models (LLMs) from scratch, enabling researchers to combine pre-trained models into more capable systems without full retraining. Evolutionary approaches…

Neural and Evolutionary Computing · Computer Science 2026-05-13 Md. Robiul Islam Niloy

Choosing a set of benchmark problems is often a key component of any empirical evaluation of iterative optimization heuristics. In continuous, single-objective optimization, several sets of problems have become widespread, including the…

Neural and Evolutionary Computing · Computer Science 2023-12-19 Diederick Vermetten , Furong Ye , Thomas Bäck , Carola Doerr

In this study, we focus on developing efficient calibration methods via Bayesian decision-making for the family of compartmental epidemiological models. The existing calibration methods usually assume that the compartmental model is cheap…

Machine Learning · Computer Science 2024-12-11 Puhua Niu , Byung-Jun Yoon , Xiaoning Qian
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