Q-fully quadratic modeling and its application in a random subspace derivative-free method

IF 16.4 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY
Yiwen Chen, Warren Hare, Amy Wiebe
{"title":"Q-fully quadratic modeling and its application in a random subspace derivative-free method","authors":"Yiwen Chen, Warren Hare, Amy Wiebe","doi":"10.1007/s10589-024-00590-8","DOIUrl":null,"url":null,"abstract":"<p>Model-based derivative-free optimization (DFO) methods are an important class of DFO methods that are known to struggle with solving high-dimensional optimization problems. Recent research has shown that incorporating random subspaces into model-based DFO methods has the potential to improve their performance on high-dimensional problems. However, most of the current theoretical and practical results are based on linear approximation models due to the complexity of quadratic approximation models. This paper proposes a random subspace trust-region algorithm based on quadratic approximations. Unlike most of its precursors, this algorithm does not require any special form of objective function. We study the geometry of sample sets, the error bounds for approximations, and the quality of subspaces. In particular, we provide a technique to construct <i>Q</i>-fully quadratic models, which is easy to analyze and implement. We present an almost-sure global convergence result of our algorithm and give an upper bound on the expected number of iterations to find a sufficiently small gradient. We also develop numerical experiments to compare the performance of our algorithm using both linear and quadratic approximation models. The numerical results demonstrate the strengths and weaknesses of using quadratic approximations.</p>","PeriodicalId":1,"journal":{"name":"Accounts of Chemical Research","volume":null,"pages":null},"PeriodicalIF":16.4000,"publicationDate":"2024-06-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Accounts of Chemical Research","FirstCategoryId":"100","ListUrlMain":"https://doi.org/10.1007/s10589-024-00590-8","RegionNum":1,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 0

Abstract

Model-based derivative-free optimization (DFO) methods are an important class of DFO methods that are known to struggle with solving high-dimensional optimization problems. Recent research has shown that incorporating random subspaces into model-based DFO methods has the potential to improve their performance on high-dimensional problems. However, most of the current theoretical and practical results are based on linear approximation models due to the complexity of quadratic approximation models. This paper proposes a random subspace trust-region algorithm based on quadratic approximations. Unlike most of its precursors, this algorithm does not require any special form of objective function. We study the geometry of sample sets, the error bounds for approximations, and the quality of subspaces. In particular, we provide a technique to construct Q-fully quadratic models, which is easy to analyze and implement. We present an almost-sure global convergence result of our algorithm and give an upper bound on the expected number of iterations to find a sufficiently small gradient. We also develop numerical experiments to compare the performance of our algorithm using both linear and quadratic approximation models. The numerical results demonstrate the strengths and weaknesses of using quadratic approximations.

Abstract Image

全二次方建模及其在随机子空间无导数方法中的应用
基于模型的无导数优化(DFO)方法是一类重要的无导数优化方法,众所周知,这类方法在解决高维优化问题时比较吃力。最近的研究表明,将随机子空间纳入基于模型的无导数优化方法有可能提高其在高维问题上的性能。然而,由于二次近似模型的复杂性,目前大多数理论和实践成果都是基于线性近似模型的。本文提出了一种基于二次逼近的随机子空间信任区域算法。与大多数前辈算法不同,该算法不需要任何特殊形式的目标函数。我们研究了样本集的几何形状、近似的误差边界以及子空间的质量。特别是,我们提供了一种构建 Q 全二次模型的技术,这种技术易于分析和实现。我们提出了算法几乎可以确定的全局收敛结果,并给出了找到足够小梯度的预期迭代次数上限。我们还进行了数值实验,使用线性和二次逼近模型比较了我们算法的性能。数值结果表明了使用二次逼近的优缺点。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
求助全文
约1分钟内获得全文 求助全文
来源期刊
Accounts of Chemical Research
Accounts of Chemical Research 化学-化学综合
CiteScore
31.40
自引率
1.10%
发文量
312
审稿时长
2 months
期刊介绍: Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance. Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
确定
请完成安全验证×
copy
已复制链接
快去分享给好友吧!
我知道了
右上角分享
点击右上角分享
0
联系我们:info@booksci.cn Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。 Copyright © 2023 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术官方微信