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We present a data-driven algorithm for efficiently computing stochastic control policies for general joint chance constrained optimal control problems. Our approach leverages the theory of kernel distribution embeddings, which allows representing expectation operators as inner products in a reproducing kernel Hilbert space. This framework enables approximately reformulating the original problem using a dataset of observed trajectories from the system without imposing prior assumptions on the parameterization of the system dynamics or the structure of the uncertainty. By optimizing over a finite subset of stochastic open-loop control trajectories, we relax the original problem to a linear program over the control parameters that can be efficiently solved using standard convex optimization techniques. We demonstrate our proposed approach in simulation on a system with nonlinear non-Markovian dynamics navigating in a cluttered environment.

Reducing the computational time required by high-fidelity, full order models (FOMs) for the solution of problems in cardiac mechanics is crucial to allow the translation of patient-specific simulations into clinical practice. While FOMs, such as those based on the finite element method, provide valuable information of the cardiac mechanical function, up to hundreds of thousands degrees of freedom may be needed to obtain accurate numerical results. As a matter of fact, simulating even just a few heartbeats can require hours to days of CPU time even on powerful supercomputers. In addition, cardiac models depend on a set of input parameters that we could let vary in order to explore multiple virtual scenarios. To compute reliable solutions at a greatly reduced computational cost, we rely on a reduced basis method empowered with a new deep-learning based operator approximation, which we refer to as Deep-HyROMnet technique. Our strategy combines a projection-based POD-Galerkin method with deep neural networks for the approximation of (reduced) nonlinear operators, overcoming the typical computational bottleneck associated with standard hyper-reduction techniques. This method is shown to provide reliable approximations to cardiac mechanics problems outperforming classical projection-based ROMs in terms of computational speed-up of orders of magnitude, and enhancing forward uncertainty quantification analysis otherwise unaffordable.

We exploit the relationship between the stochastic Koopman operator and the Kolmogorov backward equation to construct importance sampling schemes for stochastic differential equations. Specifically, we propose using eigenfunctions of the stochastic Koopman operator to approximate the Doob transform for an observable of interest (e.g., associated with a rare event) which in turn yields an approximation of the corresponding zero-variance importance sampling estimator. Our approach is broadly applicable and systematic, treating non-normal systems, non-gradient systems, and systems with oscillatory dynamics or rank-deficient noise in a common framework. In nonlinear settings where the stochastic Koopman eigenfunctions cannot be derived analytically, we use dynamic mode decomposition (DMD) methods to compute them numerically, but the framework is agnostic to the particular numerical method employed. Numerical experiments demonstrate that even coarse approximations of a few eigenfunctions, where the latter are built from non-rare trajectories, can produce effective importance sampling schemes for rare events.

A number of recent studies have proposed that linear representations are appropriate for solving nonlinear dynamical systems with quantum computers, which fundamentally act linearly on a wave function in a Hilbert space. Linear representations, such as the Koopman representation and Koopman von Neumann mechanics, have regained attention from the dynamical-systems research community. Here, we aim to present a unified theoretical framework, currently missing in the literature, with which one can compare and relate existing methods, their conceptual basis, and their representations. We also aim to show that, despite the fact that quantum simulation of nonlinear classical systems may be possible with such linear representations, a necessary projection into a feasible finite-dimensional space will in practice eventually induce numerical artifacts which can be hard to eliminate or even control. As a result a practical, reliable and accurate way to use quantum computation for solving general nonlinear dynamical systems is still an open problem.

We propose a random feature model for approximating high-dimensional sparse additive functions called the hard-ridge random feature expansion method (HARFE). This method utilizes a hard-thresholding pursuit-based algorithm applied to the sparse ridge regression (SRR) problem to approximate the coefficients with respect to the random feature matrix. The SRR formulation balances between obtaining sparse models that use fewer terms in their representation and ridge-based smoothing that tend to be robust to noise and outliers. In addition, we use a random sparse connectivity pattern in the random feature matrix to match the additive function assumption. We prove that the HARFE method is guaranteed to converge with a given error bound depending on the noise and the parameters of the sparse ridge regression model. Based on numerical results on synthetic data as well as on real datasets, the HARFE approach obtains lower (or comparable) error than other state-of-the-art algorithms.

Graph Neural Networks (GNNs) have shown promising results on a broad spectrum of applications. Most empirical studies of GNNs directly take the observed graph as input, assuming the observed structure perfectly depicts the accurate and complete relations between nodes. However, graphs in the real world are inevitably noisy or incomplete, which could even exacerbate the quality of graph representations. In this work, we propose a novel Variational Information Bottleneck guided Graph Structure Learning framework, namely VIB-GSL, in the perspective of information theory. VIB-GSL advances the Information Bottleneck (IB) principle for graph structure learning, providing a more elegant and universal framework for mining underlying task-relevant relations. VIB-GSL learns an informative and compressive graph structure to distill the actionable information for specific downstream tasks. VIB-GSL deduces a variational approximation for irregular graph data to form a tractable IB objective function, which facilitates training stability. Extensive experimental results demonstrate that the superior effectiveness and robustness of VIB-GSL.

This PhD thesis contains several contributions to the field of statistical causal modeling. Statistical causal models are statistical models embedded with causal assumptions that allow for the inference and reasoning about the behavior of stochastic systems affected by external manipulation (interventions). This thesis contributes to the research areas concerning the estimation of causal effects, causal structure learning, and distributionally robust (out-of-distribution generalizing) prediction methods. We present novel and consistent linear and non-linear causal effects estimators in instrumental variable settings that employ data-dependent mean squared prediction error regularization. Our proposed estimators show, in certain settings, mean squared error improvements compared to both canonical and state-of-the-art estimators. We show that recent research on distributionally robust prediction methods has connections to well-studied estimators from econometrics. This connection leads us to prove that general K-class estimators possess distributional robustness properties. We, furthermore, propose a general framework for distributional robustness with respect to intervention-induced distributions. In this framework, we derive sufficient conditions for the identifiability of distributionally robust prediction methods and present impossibility results that show the necessity of several of these conditions. We present a new structure learning method applicable in additive noise models with directed trees as causal graphs. We prove consistency in a vanishing identifiability setup and provide a method for testing substructure hypotheses with asymptotic family-wise error control that remains valid post-selection. Finally, we present heuristic ideas for learning summary graphs of nonlinear time-series models.

We present a learning-based approach for removing unwanted obstructions, such as window reflections, fence occlusions or raindrops, from a short sequence of images captured by a moving camera. Our method leverages the motion differences between the background and the obstructing elements to recover both layers. Specifically, we alternate between estimating dense optical flow fields of the two layers and reconstructing each layer from the flow-warped images via a deep convolutional neural network. The learning-based layer reconstruction allows us to accommodate potential errors in the flow estimation and brittle assumptions such as brightness consistency. We show that training on synthetically generated data transfers well to real images. Our results on numerous challenging scenarios of reflection and fence removal demonstrate the effectiveness of the proposed method.

Discovering causal structure among a set of variables is a fundamental problem in many empirical sciences. Traditional score-based casual discovery methods rely on various local heuristics to search for a Directed Acyclic Graph (DAG) according to a predefined score function. While these methods, e.g., greedy equivalence search, may have attractive results with infinite samples and certain model assumptions, they are usually less satisfactory in practice due to finite data and possible violation of assumptions. Motivated by recent advances in neural combinatorial optimization, we propose to use Reinforcement Learning (RL) to search for the DAG with the best scoring. Our encoder-decoder model takes observable data as input and generates graph adjacency matrices that are used to compute rewards. The reward incorporates both the predefined score function and two penalty terms for enforcing acyclicity. In contrast with typical RL applications where the goal is to learn a policy, we use RL as a search strategy and our final output would be the graph, among all graphs generated during training, that achieves the best reward. We conduct experiments on both synthetic and real datasets, and show that the proposed approach not only has an improved search ability but also allows a flexible score function under the acyclicity constraint.

Recent studies have shown the vulnerability of reinforcement learning (RL) models in noisy settings. The sources of noises differ across scenarios. For instance, in practice, the observed reward channel is often subject to noise (e.g., when observed rewards are collected through sensors), and thus observed rewards may not be credible as a result. Also, in applications such as robotics, a deep reinforcement learning (DRL) algorithm can be manipulated to produce arbitrary errors. In this paper, we consider noisy RL problems where observed rewards by RL agents are generated with a reward confusion matrix. We call such observed rewards as perturbed rewards. We develop an unbiased reward estimator aided robust RL framework that enables RL agents to learn in noisy environments while observing only perturbed rewards. Our framework draws upon approaches for supervised learning with noisy data. The core ideas of our solution include estimating a reward confusion matrix and defining a set of unbiased surrogate rewards. We prove the convergence and sample complexity of our approach. Extensive experiments on different DRL platforms show that policies based on our estimated surrogate reward can achieve higher expected rewards, and converge faster than existing baselines. For instance, the state-of-the-art PPO algorithm is able to obtain 67.5% and 46.7% improvements in average on five Atari games, when the error rates are 10% and 30% respectively.