HISAPS: High-order smoothing spline with automatic parameter selection and shape constraints

IF 2.4 4区 计算机科学 Q2 COMPUTER SCIENCE, SOFTWARE ENGINEERING SoftwareX Pub Date : 2025-02-01 Epub Date: 2025-01-21 DOI:10.1016/j.softx.2025.102049
Peter H. Broberg , Esben Lindgaard , Asbjørn M. Olesen , Simon M. Jensen , Niklas K.K. Stagsted , Rasmus L. Bjerg , Riccardo Grosselle , Iñigo Urcelay Oca , Brian L.V. Bak
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Abstract

Obtaining a good functional fit with noisy data is difficult. This is especially true when the derivative of the fitted function is needed, which is often the case in engineering applications. One solution is to use smoothing splines. However, most conventional and readily available smoothing spline software implementations are cubic with a penalty on the 2nd order derivative, which results in poor and sometimes noisy derivatives. In this paper, we present new software that can be used to make smoothing splines with a penalty on the 1st, 2nd, 3rd, or 4th order derivatives. Furthermore, the presented software allows for applying constraints to the function to impose prior knowledge, including automatic parameter selection through cross-validation for an optimum and user-independent fit.
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具有自动参数选择和形状约束的高阶平滑样条
在噪声数据中获得良好的函数拟合是很困难的。当需要对拟合函数求导时尤其如此,这在工程应用中经常出现。一种解决方法是使用平滑样条。然而,大多数传统的和现成的平滑样条软件实现是三次的,对二阶导数有惩罚,这导致导数很差,有时有噪声。在本文中,我们提出了一种新的软件,可以用来制作光滑样条,对一阶,二阶,三阶或四阶导数进行惩罚。此外,所提出的软件允许对函数施加约束以施加先验知识,包括通过交叉验证实现最佳和用户独立拟合的自动参数选择。
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来源期刊
SoftwareX
SoftwareX COMPUTER SCIENCE, SOFTWARE ENGINEERING-
CiteScore
5.50
自引率
2.90%
发文量
184
审稿时长
9 weeks
期刊介绍: SoftwareX aims to acknowledge the impact of software on today''s research practice, and on new scientific discoveries in almost all research domains. SoftwareX also aims to stress the importance of the software developers who are, in part, responsible for this impact. To this end, SoftwareX aims to support publication of research software in such a way that: The software is given a stamp of scientific relevance, and provided with a peer-reviewed recognition of scientific impact; The software developers are given the credits they deserve; The software is citable, allowing traditional metrics of scientific excellence to apply; The academic career paths of software developers are supported rather than hindered; The software is publicly available for inspection, validation, and re-use. Above all, SoftwareX aims to inform researchers about software applications, tools and libraries with a (proven) potential to impact the process of scientific discovery in various domains. The journal is multidisciplinary and accepts submissions from within and across subject domains such as those represented within the broad thematic areas below: Mathematical and Physical Sciences; Environmental Sciences; Medical and Biological Sciences; Humanities, Arts and Social Sciences. Originating from these broad thematic areas, the journal also welcomes submissions of software that works in cross cutting thematic areas, such as citizen science, cybersecurity, digital economy, energy, global resource stewardship, health and wellbeing, etcetera. SoftwareX specifically aims to accept submissions representing domain-independent software that may impact more than one research domain.
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