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Solving the capacitated vehicle routing problem with time windows via graph convolutional network assisted tree search and quantum-inspired computing 用图卷积网络辅助树搜索和量子启发计算求解带时间窗的有容量车辆路径问题
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-22 DOI: 10.3389/fams.2023.1155356
Jorin Dornemann
Vehicle routing problems are a class of NP-hard combinatorial optimization problems which attract a lot of attention, as they have many practical applications. In recent years there have been new developments solving vehicle routing problems with the help of machine learning, since learning how to automatically solve optimization problems has the potential to provide a big leap in optimization technology. Prior work on solving vehicle routing problems using machine learning has mainly focused on auto-regressive models, which are connected to high computational costs when combined with classical exact search methods as the model has to be evaluated in every search step. This paper proposes a new method for approximately solving the capacitated vehicle routing problem with time windows (CVRPTW) via a supervised deep learning-based approach in a non-autoregressive manner. The model uses a deep neural network to assist finding solutions by providing a probability distribution which is used to guide a tree search, resulting in a machine learning assisted heuristic. The model is built upon a new neural network architecture, called graph convolutional network, which is particularly suited for deep learning tasks. Furthermore, a new formulation for the CVRPTW in form of a quadratic unconstrained binary optimization (QUBO) problem is presented and solved via quantum-inspired computing in cooperation with Fujitsu, where a learned problem reduction based upon the proposed neural network is applied to circumvent limitations concerning the usage of quantum computing for large problem instances. Computational results show that the proposed models perform very well on small and medium sized instances compared to state-of-the-art solution methods in terms of computational costs and solution quality, and outperform commercial solvers for large instances.
车辆路径问题是一类NP-hard组合优化问题,因其具有广泛的实际应用而备受关注。近年来,在机器学习的帮助下解决车辆路线问题有了新的发展,因为学习如何自动解决优化问题有可能为优化技术提供一个巨大的飞跃。先前使用机器学习解决车辆路线问题的工作主要集中在自回归模型上,当与经典的精确搜索方法结合使用时,由于模型必须在每个搜索步骤中进行评估,因此计算成本很高。提出了一种基于监督深度学习的非自回归近似求解带时间窗的有能力车辆路径问题的新方法。该模型使用深度神经网络通过提供用于指导树搜索的概率分布来帮助寻找解决方案,从而产生机器学习辅助启发式。该模型建立在一种新的神经网络架构上,称为图卷积网络,特别适合深度学习任务。此外,CVRPTW以二次型无约束二进制优化(QUBO)问题的形式提出了一个新的公式,并通过与富士通合作的量子启发计算来解决,其中基于所提出的神经网络的学习问题约简应用于规避有关使用量子计算解决大问题实例的限制。计算结果表明,与最先进的解决方法相比,所提出的模型在计算成本和解决方案质量方面在中小型实例上表现非常好,并且在大型实例上优于商业解决方案。
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引用次数: 0
Structure-preserving model reduction for port-Hamiltonian systems based on separable nonlinear approximation ansatzes 基于可分离非线性逼近分析的端口-哈密顿系统保结构模型约简
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-16 DOI: 10.3389/fams.2023.1160250
P. Schulze
We discuss structure-preserving model order reduction for port-Hamiltonian systems based on a nonlinear approximation ansatz which is linear with respect to a part of the state variables of the reduced-order model. In recent years, such nonlinear approximation ansatzes have gained more and more attention especially due to their effectiveness in the context of model reduction for transport-dominated systems which are challenging for classical linear model reduction techniques. We demonstrate that port-Hamiltonian reduced-order models can often be obtained by a residual minimization approach where a suitable weighted norm is used for the residual. Moreover, we discuss sufficient conditions for the resulting reduced-order models to be stable. Finally, the methodology is illustrated by means of two transport-dominated numerical test cases, where the ansatz functions are determined based on snapshot data of the full-order state.
基于对降阶模型的部分状态变量线性化的非线性逼近,讨论了保结构模型降阶的port- hamilton系统。近年来,这种非线性逼近分析方法因其在输运主导系统模型约简中的有效性而受到越来越多的关注,这对经典的线性模型约简技术构成了挑战。我们证明了port- hamilton降阶模型通常可以通过残差最小化方法获得,其中残差使用合适的加权范数。此外,我们还讨论了所得到的降阶模型稳定的充分条件。最后,通过两个传输主导的数值测试案例说明了该方法,其中ansatz函数是基于全阶状态的快照数据确定的。
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引用次数: 2
Multipatch stochastic epidemic model for the dynamics of a tick-borne disease 蜱传疾病动力学的多匹配随机流行病模型
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-16 DOI: 10.3389/fams.2023.1122410
M. Maliyoni, H. Gaff, K. Govinder, F. Chirove
Spatial heterogeneity and migration of hosts and ticks have an impact on the spread, extinction and persistence of tick-borne diseases. In this paper, we investigate the impact of between-patch migration of white-tailed deer and lone star ticks on the dynamics of a tick-borne disease with regard to disease extinction and persistence using a system of Itô stochastic differential equations model. It is shown that the disease-free equilibrium exists and is unique. The general formula for computing the basic reproduction number for all patches is derived. We show that for patches in isolation, the basic reproduction number is equal to the largest patch reproduction number and for connected patches it lies between the minimum and maximum of the patch reproduction numbers. Numerical simulations for a two-patch deterministic and stochastic differential equation models are performed to illustrate the dynamics of the disease for varying migration rates. Our results show that the probability of eliminating or minimizing the disease in both patches is high when there is no migration unlike when it is present. The results imply that the probability of disease extinction can be increased if deer and tick movement are controlled or even prohibited especially when there is an outbreak in one or both patches since movement can introduce a disease in an area that was initially disease-free. Thus, screening of infectives in protected areas such as deer farms, private game parks or reserves, etc. before they migrate to other areas can be one of the intervention strategies for controlling and preventing disease spread.
宿主和蜱虫的空间异质性和迁移对蜱传疾病的传播、灭绝和持久性有影响。在本文中,我们使用Itô随机微分方程系统模型研究了白尾鹿和孤星蜱的斑块间迁徙对蜱传疾病的灭绝和持续性动力学的影响。结果表明,无病平衡是存在的,并且是唯一的。导出了计算所有补丁的基本再现数的通用公式。我们证明,对于孤立的补丁,基本再现数等于最大的补丁再现数,而对于连接的补丁,它位于补丁再现数的最小值和最大值之间。对两片确定性和随机微分方程模型进行了数值模拟,以说明疾病在不同迁移率下的动力学。我们的研究结果表明,当没有迁移时,与有迁移时不同,在两个斑块中消除或最小化疾病的概率都很高。研究结果表明,如果控制甚至禁止鹿和蜱虫的活动,尤其是当一个或两个地区爆发疫情时,疾病灭绝的可能性会增加,因为活动会在最初没有疾病的地区引发疾病。因此,在感染者迁移到其他地区之前,在鹿场、私人狩猎公园或保护区等保护区对其进行筛查,可以成为控制和预防疾病传播的干预策略之一。
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引用次数: 1
Invariant forms and control dimensional parameters in complexity quantification 复杂性量化中的不变形式和控制维参数
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-15 DOI: 10.3389/fams.2023.1201043
S. Abarzhi
Non-equilibrium dynamics is omnipresent in nature and technology and can exhibit symmetries and order. In idealistic systems this universality is well-captured by traditional models of dynamical systems. Realistic processes are often more complex. This work considers two paradigmatic complexities—canonical Kolmogorov turbulence and interfacial Rayleigh-Taylor mixing. We employ symmetries and invariant forms to assess very different properties and characteristics of these processes. We inter-link, for the first time, to our knowledge, the scaling laws and spectral shapes of Kolmogorov turbulence and Rayleigh-Taylor mixing. We reveal the decisive role of the control dimensional parameters in their respective dynamics. We find that the invariant forms and the control parameters provide the key insights into the attributes of the non-equilibrium dynamics, thus expanding the range of applicability of dynamical systems well-beyond traditional frameworks.
非平衡动力学在自然界和技术中无处不在,可以表现出对称性和有序性。在理想主义系统中,传统的动力系统模型很好地捕捉到了这种普遍性。现实的过程往往更为复杂。这项工作考虑了两个典型的复杂性——典型的Kolmogorov湍流和界面瑞利-泰勒混合。我们使用对称性和不变形式来评估这些过程的不同性质和特征。我们第一次将Kolmogorov湍流和Rayleigh-Taylor混合的标度定律和光谱形状联系起来。我们揭示了控制维度参数在其各自动力学中的决定性作用。我们发现,不变形式和控制参数提供了对非平衡动力学属性的关键见解,从而大大扩展了动力学系统的适用范围,远远超出了传统框架。
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引用次数: 0
Testing the forecasting skills of aftershock models using a Bayesian framework 利用贝叶斯框架测试余震模型的预测能力
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-14 DOI: 10.3389/fams.2023.1126511
Elisa Dong, R. Shcherbakov, K. Goda
The Epidemic Type Aftershock Sequence (ETAS) model and the modified Omori law (MOL) are two aftershock rate models that are used for operational earthquake/aftershock forecasting. Previous studies have investigated the relative performance of the two models for specific case studies. However, a rigorous comparative evaluation of the forecasting performance of the basic aftershock rate models for several different earthquake sequences has not been done before. In this study, forecasts of five prominent aftershock sequences from multiple catalogs are computed using the Bayesian predictive distribution, which fully accounts for the uncertainties in the model parameters. This is done by the Markov Chain Monte Carlo (MCMC) sampling of the model parameters and forward simulation of the ETAS or MOL models to compute the aftershock forecasts. The forecasting results are evaluated using five different statistical tests, including two comparison tests. The forecasting skill tests indicate that the ETAS model tends to perform consistently well on the first three tests. The MOL fails the same tests for certain forecasting time intervals. However, in the comparison tests, it is not definite whether the ETAS model is the better performing model. This work demonstrates the use of forecast testing for different catalogs, which is also applicable to catalogs with a higher magnitude of completeness.
流行病型余震序列(ETAS)模型和修正的大森定律(MOL)是用于地震/余震预报的两个余震率模型。先前的研究已经针对具体的案例研究调查了这两个模型的相对性能。然而,以前从未对几种不同地震序列的基本余震率模型的预测性能进行过严格的比较评估。在本研究中,使用贝叶斯预测分布计算了来自多个目录的五个显著余震序列的预测,该预测分布充分考虑了模型参数的不确定性。这是通过模型参数的马尔可夫链蒙特卡罗(MCMC)采样和ETAS或MOL模型的正演模拟来计算余震预报来完成的。预测结果使用五种不同的统计检验进行评估,包括两种比较检验。预测技能测试表明,ETAS模型在前三次测试中表现一贯良好。MOL在某些预测时间间隔内未通过相同的测试。然而,在比较测试中,尚不确定ETAS模型是否是性能更好的模型。这项工作演示了对不同目录的预测测试的使用,这也适用于具有更高完整性的目录。
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引用次数: 0
Editorial: Insights in mathematical biology 2022 社论:数学生物学的见解2022
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-13 DOI: 10.3389/fams.2023.1197661
R. Eftimie
COPYRIGHT © 2023 Eftimie. This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY). The use, distribution or reproduction in other forums is permitted, provided the original author(s) and the copyright owner(s) are credited and that the original publication in this journal is cited, in accordance with accepted academic practice. No use, distribution or reproduction is permitted which does not comply with these terms. Editorial: Insights in mathematical biology 2022
版权所有©2023 Eftimie。这是一篇根据知识共享署名许可(CC BY)条款发布的开放获取文章。根据公认的学术惯例,允许在其他论坛上使用、分发或复制,前提是原作者和版权所有人得到认可,并引用本期刊上的原始出版物。不允许使用、分发或复制不符合这些条款的内容。社论:数学生物学的见解2022
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引用次数: 0
Hypoxia-related radiotherapy resistance in tumors: treatment efficacy investigation in an eco-evolutionary perspective 肿瘤缺氧相关放疗抵抗:生态进化视角下的治疗疗效研究
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-10 DOI: 10.3389/fams.2023.1193191
Giulia Chiari, Giada Fiandaca, M. Delitala
In the study of therapeutic strategies for the treatment of cancer, eco-evolutionary dynamics are of particular interest, since characteristics of the tumor population, interaction with the environment and effects of the treatment, influence the geometric and epigenetic characterization of the tumor with direct consequences on the efficacy of the therapy and possible relapses. In particular, when considering radiotherapy, oxygen concentration plays a central role both in determining the effectiveness of the treatment and the selective pressure due to hypoxia.We propose a mathematical model, settled in the framework of epigenetically structured population dynamics and formulated in terms of systems of coupled non-linear integro-differential equations that aims to catch these phenomena and to provide a predictive tool for the tumor mass evolution and therapeutic effects.The outcomes of the simulations show how the model is able to explain the impact of environmental selection and therapies on the evolution of the mass, motivating observed dynamics such as relapses and therapeutic failures.This novel modeling framework, together with the experimental results obtained so far, offers a first hint for the development of therapies which can be adapted to overcome problems of resistance and relapses. Further studies, based on a quantification of medical data, could include the development of a mathematical tool for medical support in optimizing therapeutic protocols.
在癌症治疗策略的研究中,生态进化动力学尤其令人感兴趣,因为肿瘤群体的特征、与环境的相互作用和治疗效果会影响肿瘤的几何和表观遗传学特征,并对治疗效果和可能的复发产生直接影响。特别是,在考虑放射治疗时,氧气浓度在决定治疗效果和缺氧引起的选择性压力方面发挥着核心作用。我们提出了一个数学模型,该模型以表观遗传学结构的群体动力学为框架,并根据耦合的非线性积分-微分方程组进行公式化,旨在捕捉这些现象,并为肿瘤质量演变和治疗效果提供预测工具。模拟结果表明,该模型能够解释环境选择和治疗对群体进化的影响,从而激发观察到的动力学,如复发和治疗失败。这一新的建模框架,以及迄今为止获得的实验结果,为开发可用于克服耐药性和复发问题的疗法提供了第一个提示。基于医学数据量化的进一步研究可能包括开发一种数学工具,用于优化治疗方案的医疗支持。
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引用次数: 1
AI-enabled case detection model for infectious disease outbreaks in resource-limited settings 在资源有限的环境中,用于传染病爆发的人工智能病例检测模型
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-08 DOI: 10.3389/fams.2023.1133349
C. Sisimayi, C. Harley, F. Nyabadza, Maria Vivien V. Visaya
Introduction The utility of non-contact technologies for screening infectious diseases such as COVID-19 can be enhanced by improving the underlying Artificial Intelligence (AI) models and integrating them into data visualization frameworks. AI models that are a fusion of different Machine Learning (ML) models where one has leveraged the different positive attributes of these models have the potential to perform better in detecting infectious diseases such as COVID-19. Furthermore, integrating other patient data such as clinical, socio-demographic, economic and environmental variables with the image data (e.g., chest X-rays) can enhance the detection capacity of these models. Methods In this study, we explore the use of chest X-ray data in training an optimized hybrid AI model based on a real-world dataset with limited sample size to screen patients with COVID-19. We develop a hybrid Convolutional Neural Network (CNN) and Random Forest (RF) model based on image features extracted through a CNN and EfficientNet B0 Transfer Learning Model and applied to an RF classifier. Our approach includes an intermediate step of using the RF's wrapper function, the Boruta Algorithm, to select important variable features and further reduce the number of features prior to using the RF model. Results and discussion The new model obtained an accuracy and recall of 96% for both and outperformed the base CNN model and four other experimental models that combined transfer learning and alternative options for dimensionality reduction. The performance of the model fares closely to relatively similar models previously developed, which were trained on large datasets drawn from different country contexts. The performance of the model is very close to that of the “gold standard” PCR tests, which demonstrates the potential for use of this approach to efficiently scale-up surveillance and screening capacities in resource limited settings.
引言通过改进底层人工智能(AI)模型并将其集成到数据可视化框架中,可以增强非接触技术在筛查新冠肺炎等传染病方面的实用性。人工智能模型融合了不同的机器学习(ML)模型,其中利用了这些模型的不同积极属性,有可能在检测新冠肺炎等传染病方面表现更好。此外,将其他患者数据(如临床、社会人口统计、经济和环境变量)与图像数据(如胸部X光片)相结合可以增强这些模型的检测能力。方法在本研究中,我们探索使用胸部X射线数据来训练基于有限样本量的真实世界数据集的优化混合人工智能模型,以筛查新冠肺炎患者。基于通过CNN和EfficientNet B0迁移学习模型提取的图像特征,我们开发了一个卷积神经网络(CNN)和随机森林(RF)的混合模型,并将其应用于RF分类器。我们的方法包括一个中间步骤,即使用RF的包装函数Boruta算法来选择重要的可变特征,并在使用RF模型之前进一步减少特征的数量。结果和讨论新模型的准确率和召回率均为96%,优于基础CNN模型和其他四个结合了迁移学习和降维备选方案的实验模型。该模型的性能与之前开发的相对相似的模型非常相似,这些模型是在来自不同国家背景的大型数据集上训练的。该模型的性能与“金标准”PCR检测非常接近,这表明使用这种方法在资源有限的环境中有效扩大监测和筛查能力的潜力。
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引用次数: 1
Stabilizing machine learning models with Age-Period-Cohort inputs for scoring and stress testing 稳定机器学习模型与年龄-时期-队列输入评分和压力测试
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-08 DOI: 10.3389/fams.2023.1195810
J. Breeden, Ye. A. Leonova
Machine learning models have been used extensively for credit scoring, but the architectures employed suffer from a significant loss in accuracy out-of-sample and out-of-time. Further, the most common architectures do not effectively integrate economic scenarios to enable stress testing, cash flow, or yield estimation. The present research demonstrates that providing lifecycle and environment functions from Age-Period-Cohort analysis can significantly improve out-of-sample and out-of-time performance as well as enabling the model's use in both scoring and stress testing applications. This method is demonstrated for behavior scoring where account delinquency is one of the provided inputs, because behavior scoring has historically presented the most difficulties for combining credit scoring and stress testing. Our method works well in both origination and behavior scoring. The results are also compared to multihorizon survival models, which share the same architectural design with Age-Period-Cohort inputs and coefficients that vary with forecast horizon, but using a logistic regression estimation of the model. The analysis was performed on 30-year prime conforming US mortgage data. Nonlinear problems involving large amounts of alternate data are best at highlighting the advantages of machine learning. Data from Fannie Mae and Freddie Mac is not such a test case, but it serves the purpose of comparing these methods with and without Age-Period-Cohort inputs. In order to make a fair comparison, all models are given a panel structure where each account is observed monthly to determine default or non-default.
机器学习模型已被广泛用于信用评分,但所采用的架构在样本外和时间外的准确性方面存在重大损失。此外,最常见的体系结构不能有效地集成经济场景来支持压力测试、现金流或收益估计。目前的研究表明,从年龄-时期-队列分析中提供生命周期和环境功能可以显着提高样本外和时间外的性能,并使模型在评分和压力测试应用中使用。该方法用于行为评分,其中帐户拖欠是提供的输入之一,因为行为评分历来是信用评分和压力测试相结合的最大困难。我们的方法在起源和行为评分中都很有效。结果还与多水平生存模型进行了比较,多水平生存模型具有相同的结构设计,具有年龄-时期-队列输入和随预测水平变化的系数,但使用了模型的逻辑回归估计。该分析是对美国30年期优质合格抵押贷款数据进行的。涉及大量交替数据的非线性问题最能突出机器学习的优势。房利美(Fannie Mae)和房地美(Freddie Mac)的数据不是这样的测试案例,但它的目的是比较这些方法是否有年龄-时期-队列输入。为了进行公平的比较,所有模型都采用面板结构,每个帐户每月观察一次,以确定默认或非默认。
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引用次数: 0
Bayesian synthetic likelihood for stochastic models with applications in mathematical finance 随机模型的贝叶斯综合似然及其在数学金融中的应用
IF 1.4 Q3 MATHEMATICS, INTERDISCIPLINARY APPLICATIONS Pub Date : 2023-06-05 DOI: 10.3389/fams.2023.1187878
R. Maraia, Sebastian Springer, Teemu Härkönen, M. Simon, H. Haario
We present a Bayesian synthetic likelihood method to estimate both the parameters and their uncertainty in systems of stochastic differential equations. Together with novel summary statistics the method provides a generic and model-agnostic estimation procedure and is shown to perform well even for small observational data sets and biased observations of latent processes. Moreover, a strategy for assessing the goodness of the model fit to the observational data is provided. The combination of the aforementioned features differentiates our approach from other well-established estimation methods. We would like to stress the fact that the algorithm is pleasingly parallel and thus well suited for implementation on modern computing hardware. We test and compare the method to maximum likelihood, filtering and transition density estimation methods on a number of practically relevant examples from mathematical finance. Additionally, we analyze how to treat the lack-of-fit in situations where the model is biased due to the necessity of using proxies in place of unobserved volatility.
我们提出了一种贝叶斯综合似然方法来估计随机微分方程组的参数及其不确定性。该方法与新颖的汇总统计数据一起提供了一种通用的、模型不可知的估计程序,并且即使对于小的观测数据集和潜在过程的偏差观测也表现良好。此外,还提供了一种评估模型与观测数据拟合优度的策略。上述特征的组合使我们的方法与其他公认的估计方法不同。我们想强调的是,该算法是令人愉快的并行算法,因此非常适合在现代计算硬件上实现。我们在数学金融的一些实际相关例子中测试并比较了该方法与最大似然、滤波和转移密度估计方法。此外,我们还分析了在模型因使用代理代替未观察到的波动性而存在偏差的情况下,如何处理不匹配。
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引用次数: 0
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Frontiers in Applied Mathematics and Statistics
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