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Generative hyperelasticity with physics-informed probabilistic diffusion fields 利用物理信息概率扩散场生成超弹性
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-18 DOI: 10.1007/s00366-024-01984-2
Vahidullah Taç, Manuel K. Rausch, Ilias Bilionis, Francisco Sahli Costabal, Adrian Buganza Tepole

Many natural materials exhibit highly complex, nonlinear, anisotropic, and heterogeneous mechanical properties. Recently, it has been demonstrated that data-driven strain energy functions possess the flexibility to capture the behavior of these complex materials with high accuracy while satisfying physics-based constraints. However, most of these approaches disregard the uncertainty in the estimates and the spatial heterogeneity of these materials. In this work, we leverage recent advances in generative models to address these issues. We use as building block neural ordinary equations (NODE) that—by construction—create polyconvex strain energy functions, a key property of realistic hyperelastic material models. We combine this approach with probabilistic diffusion models to generate new samples of strain energy functions. This technique allows us to sample a vector of Gaussian white noise and translate it to NODE parameters thereby representing plausible strain energy functions. We extend our approach to spatially correlated diffusion resulting in heterogeneous material properties for arbitrary geometries. We extensively test our method with synthetic and experimental data on biological tissues and run finite element simulations with various degrees of spatial heterogeneity. We believe this approach is a major step forward including uncertainty in predictive, data-driven models of hyperelasticity.

许多天然材料表现出高度复杂、非线性、各向异性和异质的机械特性。最近的研究表明,数据驱动的应变能函数具有很高的灵活性,可以高精度地捕捉这些复杂材料的行为,同时满足基于物理学的约束条件。然而,这些方法大多忽略了估计值的不确定性和这些材料的空间异质性。在这项工作中,我们利用生成模型的最新进展来解决这些问题。我们使用神经普通方程(NODE)作为构建模块,通过构造创建多凸应变能函数,这是现实超弹性材料模型的一个关键属性。我们将这种方法与概率扩散模型相结合,生成新的应变能函数样本。这种技术允许我们对高斯白噪声矢量进行采样,并将其转换为 NODE 参数,从而代表可信的应变能函数。我们将方法扩展到空间相关扩散,从而产生任意几何形状的异质材料特性。我们用生物组织的合成数据和实验数据对我们的方法进行了广泛测试,并对不同程度的空间异质性进行了有限元模拟。我们相信,这种方法是将不确定性纳入超弹性预测模型和数据驱动模型的重要一步。
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引用次数: 0
Enforcing local boundary conditions in peridynamic models of diffusion with singularities and on arbitrary domains 在具有奇点和任意域的周扩散动态模型中执行局部边界条件
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-18 DOI: 10.1007/s00366-024-01995-z
Jiangming Zhao, Siavash Jafarzadeh, Ziguang Chen, Florin Bobaru

Abstract

Imposing local boundary conditions and mitigating the surface effect at free surfaces in peridynamic (PD) models are often desired. The fictitious nodes method (FNM) “extends” the domain with a thin fictitious layer of thickness equal to the PD horizon size, and is a commonly used technique for these purposes. The FNM, however, is limited, in general, to domains with simple geometries. Here we introduce an algorithm for the mirror-based FNM that can be applied to arbitrary domain geometries. The algorithm automatically determines mirror nodes (in the given domain) of all fictitious nodes based on approximating, at each fictitious node, the “generalized” (or nonlocal) normal vector to the domain boundary. We tested the new algorithm for a peridynamic model of a classical diffusion problem with a flux singularity on the boundary. We show that other types of FNMs exhibit “pollution” of the solution far from the singularity point, while the mirror-based FNM does not and, in addition, shows a significantly faster rate of convergence to the classical solution in the limit of the horizon going to zero. The new algorithm is then used for mirror-based FNM solutions of diffusion problems in domains with curvilinear boundaries and with intersecting cracks. The proposed algorithm significantly improves the accuracy near boundaries of domains of arbitrary shapes, including those with corners, notches, and crack tips.

Graphical Abstract

摘要 在周动力学(PD)模型中经常需要在自由表面施加局部边界条件和减轻表面效应。虚构节点法(FNM)用厚度等于 PD 水平面尺寸的虚构薄层 "扩展 "域,是实现这些目的的常用技术。然而,FNM 通常仅限于具有简单几何形状的域。在此,我们介绍一种基于镜像的 FNM 算法,该算法可应用于任意几何形状的畴。该算法基于在每个虚构节点上近似域边界的 "广义"(或非局部)法向量,自动确定(给定域中)所有虚构节点的镜像节点。我们在一个经典扩散问题的周动态模型中测试了这种新算法,该模型的边界上有一个通量奇点。我们发现,其他类型的 FNM 会 "污染 "远离奇点的解,而基于镜像的 FNM 则不会,此外,在水平线归零的极限情况下,它向经典解的收敛速度明显更快。新算法随后被用于在具有曲线边界和相交裂缝的域中求解基于镜像的 FNM 扩散问题。所提出的算法极大地提高了任意形状域边界附近的精确度,包括具有拐角、缺口和裂缝尖端的域。
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引用次数: 0
Corner error reduction by Chebyshev transformed orthogonal grid 通过切比雪夫变换正交网格减少边角误差
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-14 DOI: 10.1007/s00366-024-01991-3
Zebin Zhang, Shizhao Jing, Yaohui Li, Xianzong Meng

In the context of surrogate-based optimization, the efficient global exploration of the design space strongly relies on the overall accuracy of the surrogate model. For most modeling approaches, significant inaccuracies are often observed at the outlier region of the design space, where very few samples are spotted, known as the “corner error”. Inspired by the Runge effect originating from equidistant samples, a Chebyshev-transformed Orthogonal Latin Hypercube sampling approach is proposed to alleviate corner errors. An initial OLH sample was generated on a unit hyper-sphere, and its radial projection was used as the start of a sequential sampling process. The acquisition function uses the confidence interval of the Kriging predictor, combined with the min–max-distance criterion. To testify the proposed approach, models built with ordinary OLH grids are compared to the models built with Chebyshev-transformed OLH grids. Benchmark tests were performed on a series of multimodal functions, four 2-dimensional functions, and three 6-dimensional functions, both the root mean-squared error and the maximum error were reduced compared with the OLH design for most of the tests. This approach was applied to increase the pressure rise of the engine cooling fan without reducing the efficiency, for which 2.5% higher pressure rise was gained compared to the reference design.

在基于代用模型的优化中,设计空间的高效全局探索在很大程度上依赖于代用模型的整体准确性。对于大多数建模方法来说,在设计空间的离群点区域往往会出现严重的误差,因为在该区域只有很少的样本被发现,这就是所谓的 "角误差"。受等距采样产生的 Runge 效应的启发,我们提出了一种切比雪夫变换正交拉丁超立方采样方法来缓解边角误差。在单位超球上生成初始 OLH 样本,并以其径向投影作为顺序采样过程的起点。采集函数使用克里金预测器的置信区间,并结合最小-最大-距离准则。为了验证所提出的方法,使用普通 OLH 网格建立的模型与使用切比雪夫变换 OLH 网格建立的模型进行了比较。对一系列多模态函数、四个二维函数和三个六维函数进行了基准测试,在大多数测试中,与 OLH 设计相比,均方根误差和最大误差都有所减少。这种方法被用于在不降低效率的情况下提高发动机冷却风扇的压升,与参考设计相比,压升提高了 2.5%。
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引用次数: 0
Predictive insights into nonlinear nanofluid flow in rotating systems: a machine learning approach 旋转系统中非线性纳米流体流动的预测见解:一种机器学习方法
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-14 DOI: 10.1007/s00366-024-01993-1
Naveed Ahmad Khan, Muhammad Sulaiman, Benzhou Lu

This research seeks to explore the heat shift mechanisms in a rotating system that contains a hybrid nanofluid comprising of graphene oxide and copper particles mixed with pure water, using a novel methodology. The fluid flow in a rotating system is described by mathematical equations that involve nonlinear partial differential equations (PDEs). These equations are simplified by using similarity transformations, resulting in a system of ordinary differential equations. In general, it is not feasible to find a closed-form analytical solution for nonlinear ordinary differential equations (ODEs), which implies that determining an exact mathematical expression that characterizes the behavior of the solution to such ODEs is often challenging or impossible. To that end, we have utilized the controlled learning procedure of machine learning algorithms to predict the solutions for the nonlinear nanofluid problem flowing in the rotating system. The surrogated model are developed for different cases and scenarios, to review the might of differences in various physical parameters on the profiles of the fluid. Furthermore, the solutions are supported by performing an extensive statistical analysis based on different errors. It is concluded that machine learning-based method can potentially provide insights into the underlying physics of nonlinear flow problems, which can aid in the progress of more advanced and accurate models for prognosticating the behavior of nonlinear systems.

本研究采用一种新颖的方法,试图探索包含由氧化石墨烯和铜粒子与纯水混合而成的混合纳米流体的旋转系统中的热转移机制。旋转系统中的流体流动由数学方程描述,其中涉及非线性偏微分方程 (PDE)。这些方程通过相似性变换得到简化,形成常微分方程系统。一般来说,要为非线性常微分方程(ODEs)找到闭式解析解是不可行的,这意味着要确定一个精确的数学表达式来描述此类 ODEs 的解的行为特征往往是具有挑战性的,甚至是不可能的。为此,我们利用机器学习算法的受控学习程序来预测旋转系统中流动的非线性纳米流体问题的解。我们针对不同的情况和场景开发了代用模型,以审查各种物理参数的差异对流体剖面的影响。此外,还根据不同误差进行了广泛的统计分析,为解决方案提供支持。结论是,基于机器学习的方法有可能为非线性流动问题的基本物理原理提供深入见解,从而有助于开发更先进、更精确的模型,对非线性系统的行为进行预报。
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引用次数: 0
Data-driven simulation of network-based tau spreading tailored to individual Alzheimer's patients 针对阿尔茨海默氏症患者个体的基于网络的 tau 传播的数据驱动模拟
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-13 DOI: 10.1007/s00366-024-01988-y
Sung-Woo Kim, Hanna Cho, Yeonjeong Lee, Chul Hyoung Lyoo, Joon-Kyung Seong

Tau tangles in the brain cortex spread along the brain network in distinct patterns among Alzheimer's patients. We aim to simulate their network-based spreading within the cortex, tailored to each individual along the Alzheimer's continuum, without assuming any assumptions about the network architecture. A group-level intrinsic spreading network was constructed to model the pathways for the proximal and distal spreading of tau tangles by optimizing the biophysical model based on a discovery dataset of longitudinal tau positron emission tomography images for 78 amyloid-positive individuals. Group-level spreading parameters were also obtained and subsequently adjusted to produce individuated tau trajectories. By simulating these individuated tau spreading models for every individual in the discovery dataset, we successfully captured proximal and distal tau spreading, allowing reliable inferences about the underlying mechanism of tau spreading. Simulating the models also allowed highly accurate prediction of future tau topography for both discovery and independent validation datasets.

阿尔茨海默氏症患者大脑皮层中的 Tau 结沿着大脑网络以不同的模式扩散。我们的目标是模拟它们在大脑皮层中基于网络的扩散,为阿尔茨海默氏症连续体中的每个个体量身定制,而不对网络结构做任何假设。通过优化生物物理模型,构建了一个群体级的固有扩散网络,以78名淀粉样蛋白阳性患者的纵向tau正电子发射断层扫描图像发现数据集为基础,模拟tau缠结的近端和远端扩散途径。此外,还获得了群体水平的扩散参数,并随后进行了调整,以生成个体化的 tau 轨迹。通过为发现数据集中的每个个体模拟这些个体化的 tau 扩散模型,我们成功地捕捉到了 tau 的近端和远端扩散,从而可靠地推断出了 tau 扩散的基本机制。模拟这些模型还能高度准确地预测发现数据集和独立验证数据集的未来头尾拓扑结构。
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引用次数: 0
Interpreting and generalizing deep learning in physics-based problems with functional linear models 用函数线性模型解释和概括基于物理问题的深度学习
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-08 DOI: 10.1007/s00366-024-01987-z
Amirhossein Arzani, Lingxiao Yuan, Pania Newell, Bei Wang

Although deep learning has achieved remarkable success in various scientific machine learning applications, its opaque nature poses concerns regarding interpretability and generalization capabilities beyond the training data. Interpretability is crucial and often desired in modeling physical systems. Moreover, acquiring extensive datasets that encompass the entire range of input features is challenging in many physics-based learning tasks, leading to increased errors when encountering out-of-distribution (OOD) data. In this work, motivated by the field of functional data analysis (FDA), we propose generalized functional linear models as an interpretable surrogate for a trained deep learning model. We demonstrate that our model could be trained either based on a trained neural network (post-hoc interpretation) or directly from training data (interpretable operator learning). A library of generalized functional linear models with different kernel functions is considered and sparse regression is used to discover an interpretable surrogate model that could be analytically presented. We present test cases in solid mechanics, fluid mechanics, and transport. Our results demonstrate that our model can achieve comparable accuracy to deep learning and can improve OOD generalization while providing more transparency and interpretability. Our study underscores the significance of interpretable representation in scientific machine learning and showcases the potential of functional linear models as a tool for interpreting and generalizing deep learning.

虽然深度学习在各种科学机器学习应用中取得了显著的成功,但其不透明的特性也引发了人们对训练数据之外的可解释性和泛化能力的担忧。在物理系统建模中,可解释性是至关重要的,而且往往是人们所期望的。此外,在许多基于物理的学习任务中,获取涵盖整个输入特征范围的广泛数据集具有挑战性,导致在遇到分布外(OOD)数据时误差增加。在这项工作中,受函数数据分析(FDA)领域的启发,我们提出了广义函数线性模型,作为训练有素的深度学习模型的可解释替代物。我们证明,我们的模型既可以基于训练有素的神经网络(事后解释)进行训练,也可以直接从训练数据(可解释算子学习)进行训练。我们考虑了具有不同核函数的广义函数线性模型库,并利用稀疏回归发现了一个可以分析呈现的可解释代用模型。我们介绍了固体力学、流体力学和运输方面的测试案例。结果表明,我们的模型可以达到与深度学习相当的精度,并能提高 OOD 的泛化能力,同时提供更高的透明度和可解释性。我们的研究强调了可解释表征在科学机器学习中的重要性,并展示了函数线性模型作为解释和泛化深度学习工具的潜力。
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引用次数: 0
Nonlinear electromechanical topology optimization method for stretchable electronic interconnect structures 用于可拉伸电子互连结构的非线性机电拓扑优化方法
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-08 DOI: 10.1007/s00366-024-01996-y
Yunfeng Luo, Shiyuan Qu, Shutian Liu, YongAn Huang

The conductive interconnect structure that connects the electrical functional devices is an important micro-nano structure in stretchable electronics. Given the reliance of numerous devices on steady electrical currents for operation, stretchable electronics would benefit from interconnects with minimal resistance variation during deformation. This paper proposes a topology optimization method for the design of stretchable interconnect structures with stable resistance under large deformation. In the proposed method, an equal material method considering geometrically nonlinear and electromechanical coupling effects is developed to evaluate the resistance of a deformed structure. Besides, a new connectivity control method is proposed to ensure the connectivity between the inlet and outlet by making full use of the electrical problem itself. To achieve the design goal of connected interconnect structures with negligible resistance fluctuation during stretching, a topology optimization formulation is established, and the corresponding sensitivity is also analytically derived. Several numerical examples show that the proposed method is capable of computationally and intelligently generating stretchable structures with extremely small variations in resistance during stretching.

连接电气功能器件的导电互连结构是可拉伸电子器件中的重要微纳结构。鉴于众多器件的运行依赖于稳定的电流,变形过程中电阻变化最小的互连结构将使可拉伸电子器件受益匪浅。本文提出了一种拓扑优化方法,用于设计在大变形下具有稳定电阻的可拉伸互连结构。在该方法中,考虑到几何非线性和机电耦合效应,开发了一种等材料方法来评估变形结构的电阻。此外,还提出了一种新的连通性控制方法,通过充分利用电气问题本身来确保入口和出口之间的连通性。为实现连接互连结构在拉伸过程中电阻波动可忽略不计的设计目标,建立了拓扑优化公式,并分析推导出相应的灵敏度。几个数值实例表明,所提出的方法能够通过计算智能地生成拉伸过程中电阻变化极小的可拉伸结构。
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引用次数: 0
The development of an ALE finite element and discontinuous Galerkin method for the non-isothermal non-Newtonian FSI problem 针对非等温非牛顿 FSI 问题开发 ALE 有限元和非连续 Galerkin 方法
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-08 DOI: 10.1007/s00366-024-01986-0
Puyang Gao, Xiaolin Hu

In this paper, we develop a semi-implicit partitioned finite element and discontinuous Galerkin method for the non-isothermal non-Newtonian fluid structure interaction (NNFSI) problem within the arbitrary Lagrangian–Eulerian (ALE) framework. The structure is composed of the elastic solid material. The entire mathematical model consists of the governing equations of the non-Newtonian fluid and the structure, as well as the boundary conditions on the contacting interface. The rheological behavior of non-Newtonian fluid is described according to the power law constitutive equation. The whole system is split into several sub-equations and then appropriate finite element method or discontinuous Galerkin method is employed for the spatial discretizations of them. As for the deformation of the structure and the change of the fluid area and computational mesh, we employ the moving mesh technique to handle them. The problem involving a hot flexible rod fixed on the hot bottom of an irregular pipe is fully investigated. The influences of the fluid inlet velocity and the behavior of the fluid on the deformation of the rod and the temperature distribution are all analyzed.

本文针对任意拉格朗日-欧勒(ALE)框架内的非等温非牛顿流体结构相互作用(NNFSI)问题,开发了一种半隐式分区有限元和非连续 Galerkin 方法。结构由弹性固体材料组成。整个数学模型包括非牛顿流体和结构的控制方程,以及接触界面的边界条件。非牛顿流体的流变行为根据幂律构成方程进行描述。整个系统被分割成若干子方程,然后采用适当的有限元法或非连续 Galerkin 法对其进行空间离散化。对于结构的变形以及流体面积和计算网格的变化,我们采用了移动网格技术来处理。我们全面研究了固定在不规则管道热底部的热柔性杆问题。分析了流体入口速度和流体行为对杆的变形和温度分布的影响。
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引用次数: 0
PINN-based forward and inverse bending analysis of nanobeams on a three-parameter nonlinear elastic foundation including hardening and softening effect using nonlocal elasticity theory 利用非局部弹性理论,基于 PINN 对三参数非线性弹性地基上的纳米梁(包括硬化和软化效应)进行正向和反向弯曲分析
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-07 DOI: 10.1007/s00366-024-01985-1
Omid Kianian, Saeid Sarrami, Bashir Movahedian, Mojtaba Azhari

This paper introduces the application of Physics-Informed Neural Network (PINN), a novel class of scientific machine learning techniques, for analyzing the static bending response of nanobeams as essential structural elements in micro/nanoelectromechanical systems, including nanoprobes, atomic force microscope sensors, nanoswitches, nanoactuators, and nanoscale biosensors on a three-parameter nonlinear elastic foundation. The study combines Euler–Bernoulli beam theory and Eringen’s nonlocal continuum theory to derive the governing differential equation using the minimum total potential energy principle. PINN is utilized for approximating the differential equation solution and identifying the nanobeam’s nonlocal parameter through an inverse problem with measurement data. The loss function incorporates terms representing the initial and boundary conditions, along with the differential equation residual at specific points in the domain and boundary. The research demonstrates PINN’s efficacy in analyzing nanobeam behavior on nonlinear elastic foundations, providing valuable insights into responses under different loading and boundary conditions. The proposed approach's accuracy and efficiency are validated through comparisons with existing literature. Additionally, the study investigates the effects of activation functions, collocation points’ number and distribution, nonlocal parameter, foundation stiffness coefficients, loading types, and various boundary conditions on nanobeam bending behavior.

本文介绍了物理信息神经网络(PINN)这一新型科学机器学习技术在分析纳米梁静态弯曲响应中的应用,纳米梁是微/纳米机电系统中的重要结构元件,包括三参数非线性弹性基础上的纳米微生物、原子力显微镜传感器、纳米开关、纳米致动器和纳米生物传感器。研究结合了欧拉-伯努利梁理论和艾林根的非局部连续理论,利用最小总势能原理推导出支配微分方程。利用 PINN 近似微分方程解,并通过测量数据的反问题确定纳米梁的非局部参数。损失函数包含代表初始条件和边界条件的项,以及域和边界特定点的微分方程残差。该研究证明了 PINN 在分析非线性弹性地基上的纳米梁行为方面的功效,为了解不同加载和边界条件下的响应提供了宝贵的见解。通过与现有文献的比较,验证了所提出方法的准确性和效率。此外,研究还探讨了激活函数、定位点数量和分布、非局部参数、地基刚度系数、加载类型和各种边界条件对纳米梁弯曲行为的影响。
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引用次数: 0
IGA-SPH: coupling isogeometric analysis with smoothed particle hydrodynamics for air-blast–structure interaction IGA-SPH:将等距分析与平滑粒子流体力学耦合起来,用于气爆与结构的相互作用
IF 8.7 2区 工程技术 Q1 Mathematics Pub Date : 2024-05-07 DOI: 10.1007/s00366-024-01978-0
Mohammad Naqib Rahimi, Georgios Moutsanidis

We introduce a novel immersed-like numerical framework that combines isogeometric analysis with smoothed particle hydrodynamics for simulating air-blast–structure interaction. The solid domain is represented by a Lagrangian point cloud, which is immersed into a background Eulerian fluid domain. The smoothed particle hydrodynamics framework is employed to solve the equations of motion of the solid point cloud, whereas isogeometric analysis is used for the fluid mechanics equations on the background domain. The coupling strategy relies on a penalty-based volumetric coupling scheme that penalizes the velocity difference between the two domains, and involves a minimal amount of modification to existing codes, resulting in a straightforward implementation. The immersed nature of the proposed approach, combined with volumetric coupling, eliminates the need for explicit tracking of fluid–structure interfaces and imposes no limitations on solid domain motion and topology. Ample mathematical details are provided, and the proposed method is verified and validated against established numerical tools and experimental studies. The results affirm the method’s accuracy, robustness, and ease with which it seamlessly integrates two distinct computational techniques.

我们介绍了一种新颖的类沉浸数值框架,它将等距分析与平滑粒子流体力学相结合,用于模拟气爆与结构的相互作用。固体域由拉格朗日点云表示,该点云沉浸在背景欧拉流体域中。平滑粒子流体力学框架用于求解固体点云的运动方程,而背景域上的流体力学方程则采用等距分析法。耦合策略依赖于基于惩罚的体积耦合方案,该方案对两个域之间的速度差进行惩罚,只需对现有代码进行少量修改即可直接实施。所提方法的沉浸性质与体积耦合相结合,无需对流体-结构界面进行显式跟踪,也不会对实体域的运动和拓扑结构造成限制。本文提供了大量数学细节,并根据已有的数值工具和实验研究对所提出的方法进行了验证和确认。结果肯定了该方法的准确性、稳健性以及将两种不同计算技术无缝集成的易用性。
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引用次数: 0
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