We present two families of sub-grid scale (SGS) turbulence models developed for large-eddy simulation (LES) purposes. Their development required the formulation of physics-informed robust and efficient Deep Learning (DL) algorithms which, unlike state-of-the-art analytical modeling techniques can produce high-order complex non-linear relations between inputs and outputs. Explicit filtering of data from direct simulations of the canonical channel flow at two friction Reynolds numbers $Re_\tau\approx 395$ and 590 provided accurate data for training and testing. The two sets of models use different network architectures. One of the architectures uses tensor basis neural networks (TBNN) and embeds the simplified analytical model form of the general effective-viscosity hypothesis, thus incorporating the Galilean, rotational and reflectional invariances. The other architecture is that of a relatively simple network, that is able to incorporate the Galilean invariance only. However, this simpler architecture has better feature extraction capacity owing to its ability to establish relations between and extract information from cross-components of the integrity basis tensors and the SGS stresses. Both sets of models are used to predict the SGS stresses for feature datasets generated with different filter widths, and at different Reynolds numbers. It is shown that due to the simpler model's better feature learning capabilities, it outperforms the invariance embedded model in statistical performance metrics. In a priori tests, both sets of models provide similar levels of dissipation and backscatter. Based on the test results, both sets of models should be usable in a posteriori actual LESs.
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ACM/IEEE第23屆模型驅動工程語言和系統國際會議，是模型驅動軟件和系統工程的首要會議系列，由ACM-SIGSOFT和IEEE-TCSE支持組織。自1998年以來，模型涵蓋了建模的各個方面，從語言和方法到工具和應用程序。模特的參加者來自不同的背景，包括研究人員、學者、工程師和工業專業人士。MODELS 2019是一個論壇，參與者可以圍繞建模和模型驅動的軟件和系統交流前沿研究成果和創新實踐經驗。今年的版本將為建模社區提供進一步推進建模基礎的機會，并在網絡物理系統、嵌入式系統、社會技術系統、云計算、大數據、機器學習、安全、開源等新興領域提出建模的創新應用以及可持續性。
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This paper presents a novel approach to construct regularizing operators for severely ill-posed Fredholm integral equations of the first kind by introducing parametrized discretization. The optimal values of discretization and regularization parameters are computed simultaneously by solving a minimization problem formulated based on a regularization parameter search criterion. The effectiveness of the proposed approach is demonstrated through examples of noisy Laplace transform inversions and the deconvolution of nuclear magnetic resonance relaxation data.
Quantum machine learning (QML) represents a promising frontier in the realm of quantum technologies. In this pursuit of quantum advantage, the quantum kernel method for support vector machine has emerged as a powerful approach. Entanglement, a fundamental concept in quantum mechanics, assumes a central role in quantum computing. In this paper, we study the necessities of entanglement gates in the quantum kernel methods. We present several fitness functions for a multi-objective genetic algorithm that simultaneously maximizes classification accuracy while minimizing both the local and non-local gate costs of the quantum feature map's circuit. We conduct comparisons with classical classifiers to gain insights into the benefits of employing entanglement gates. Surprisingly, our experiments reveal that the optimal configuration of quantum circuits for the quantum kernel method incorporates a proportional number of non-local gates for entanglement, contrary to previous literature where non-local gates were largely suppressed. Furthermore, we demonstrate that the separability indexes of data can be effectively leveraged to determine the number of non-local gates required for the quantum support vector machine's feature maps. This insight can significantly aid in selecting appropriate parameters, such as the entanglement parameter, in various quantum programming packages like //qiskit.org/ based on data analysis. Our findings offer valuable guidance for enhancing the efficiency and accuracy of quantum machine learning algorithm
This paper explores the generalization characteristics of iterative learning algorithms with bounded updates for non-convex loss functions, employing information-theoretic techniques. Our key contribution is a novel bound for the generalization error of these algorithms with bounded updates, extending beyond the scope of previous works that only focused on Stochastic Gradient Descent (SGD). Our approach introduces two main novelties: 1) we reformulate the mutual information as the uncertainty of updates, providing a new perspective, and 2) instead of using the chaining rule of mutual information, we employ a variance decomposition technique to decompose information across iterations, allowing for a simpler surrogate process. We analyze our generalization bound under various settings and demonstrate improved bounds when the model dimension increases at the same rate as the number of training data samples. To bridge the gap between theory and practice, we also examine the previously observed scaling behavior in large language models. Ultimately, our work takes a further step for developing practical generalization theories.
Developing an efficient computational scheme for high-dimensional Bayesian variable selection in generalised linear models and survival models has always been a challenging problem due to the absence of closed-form solutions for the marginal likelihood. The RJMCMC approach can be employed to samples model and coefficients jointly, but effective design of the transdimensional jumps of RJMCMC can be challenge, making it hard to implement. Alternatively, the marginal likelihood can be derived using data-augmentation scheme e.g. Polya-gamma data argumentation for logistic regression) or through other estimation methods. However, suitable data-augmentation schemes are not available for every generalised linear and survival models, and using estimations such as Laplace approximation or correlated pseudo-marginal to derive marginal likelihood within a locally informed proposal can be computationally expensive in the "large n, large p" settings. In this paper, three main contributions are presented. Firstly, we present an extended Point-wise implementation of Adaptive Random Neighbourhood Informed proposal (PARNI) to efficiently sample models directly from the marginal posterior distribution in both generalised linear models and survival models. Secondly, in the light of the approximate Laplace approximation, we also describe an efficient and accurate estimation method for the marginal likelihood which involves adaptive parameters. Additionally, we describe a new method to adapt the algorithmic tuning parameters of the PARNI proposal by replacing the Rao-Blackwellised estimates with the combination of a warm-start estimate and an ergodic average. We present numerous numerical results from simulated data and 8 high-dimensional gene fine mapping data-sets to showcase the efficiency of the novel PARNI proposal compared to the baseline add-delete-swap proposal.
We give a short survey of recent results on sparse-grid linear algorithms of approximate recovery and integration of functions possessing a unweighted or weighted Sobolev mixed smoothness based on their sampled values at a certain finite set. Some of them are extended to more general cases.
This work proposes an adjacent-category autoregressive model for time series of ordinal variables. We apply this model to dendrochronological records to study the effect of climate on the intensity of spruce budworm defoliation during outbreaks in two sites in eastern Canada. The model's parameters are estimated using the maximum likelihood approach. We show that this estimator is consistent and asymptotically Gaussian distributed. We also propose a Portemanteau test for goodness-of-fit. Our study shows that the seasonal ranges of maximum daily temperatures in the spring and summer have a significant quadratic effect on defoliation. The study reveals that for both regions, a greater range of summer daily maximum temperatures is associated with lower levels of defoliation up to a threshold estimated at 22.7C (CI of 0-39.7C at 95%) in T\'emiscamingue and 21.8C (CI of 0-54.2C at 95%) for Matawinie. For Matawinie, a greater range in spring daily maximum temperatures increased defoliation, up to a threshold of 32.5C (CI of 0-80.0C). We also present a statistical test to compare the autoregressive parameter values between different fits of the model, which allows us to detect changes in the defoliation dynamics between the study sites in terms of their respective autoregression structures.
The semi-empirical nature of best-estimate models closing the balance equations of thermal-hydraulic (TH) system codes is well-known as a significant source of uncertainty for accuracy of output predictions. This uncertainty, called model uncertainty, is usually represented by multiplicative (log-)Gaussian variables whose estimation requires solving an inverse problem based on a set of adequately chosen real experiments. One method from the TH field, called CIRCE, addresses it. We present in the paper a generalization of this method to several groups of experiments each having their own properties, including different ranges for input conditions and different geometries. An individual (log-)Gaussian distribution is therefore estimated for each group in order to investigate whether the model uncertainty is homogeneous between the groups, or should depend on the group. To this end, a multi-group CIRCE is proposed where a variance parameter is estimated for each group jointly to a mean parameter common to all the groups to preserve the uniqueness of the best-estimate model. The ECME algorithm for Maximum Likelihood Estimation is adapted to the latter context, then applied to relevant demonstration cases. Finally, it is tested on a practical case to assess the uncertainty of critical mass flow assuming two groups due to the difference of geometry between the experimental setups.
We study the machine learning task for models with operators mapping between the Wasserstein space of probability measures and a space of functions, like e.g. in mean-field games/control problems. Two classes of neural networks, based on bin density and on cylindrical approximation, are proposed to learn these so-called mean-field functions, and are theoretically supported by universal approximation theorems. We perform several numerical experiments for training these two mean-field neural networks, and show their accuracy and efficiency in the generalization error with various test distributions. Finally, we present different algorithms relying on mean-field neural networks for solving time-dependent mean-field problems, and illustrate our results with numerical tests for the example of a semi-linear partial differential equation in the Wasserstein space of probability measures.
The inherent nature of patient data poses several challenges. Prevalent cases amass substantial longitudinal data owing to their patient volume and consistent follow-ups, however, longitudinal laboratory data are renowned for their irregularity, temporality, absenteeism, and sparsity; In contrast, recruitment for rare or specific cases is often constrained due to their limited patient size and episodic observations. This study employed self-supervised learning (SSL) to pretrain a generalized laboratory progress (GLP) model that captures the overall progression of six common laboratory markers in prevalent cardiovascular cases, with the intention of transferring this knowledge to aid in the detection of specific cardiovascular event. GLP implemented a two-stage training approach, leveraging the information embedded within interpolated data and amplify the performance of SSL. After GLP pretraining, it is transferred for TVR detection. The proposed two-stage training improved the performance of pure SSL, and the transferability of GLP exhibited distinctiveness. After GLP processing, the classification exhibited a notable enhancement, with averaged accuracy rising from 0.63 to 0.90. All evaluated metrics demonstrated substantial superiority (p < 0.01) compared to prior GLP processing. Our study effectively engages in translational engineering by transferring patient progression of cardiovascular laboratory parameters from one patient group to another, transcending the limitations of data availability. The transferability of disease progression optimized the strategies of examinations and treatments, and improves patient prognosis while using commonly available laboratory parameters. The potential for expanding this approach to encompass other diseases holds great promise.
Modern applications of survival analysis increasingly involve time-dependent covariates. The Python package BoXHED2.0 is a tree-boosted hazard estimator that is fully nonparametric, and is applicable to survival settings far more general than right-censoring, including recurring events and competing risks. BoXHED2.0 is also scalable to the point of being on the same order of speed as parametric boosted survival models, in part because its core is written in C++ and it also supports the use of GPUs and multicore CPUs. BoXHED2.0 is available from PyPI and also from www.github.com/BoXHED.
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