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Identification of nonlinear dynamical systems is crucial across various fields, facilitating tasks such as control, prediction, optimization, and fault detection. Many applications require methods capable of handling complex systems while providing strong learning guarantees for safe and reliable performance. However, existing approaches often focus on simplified scenarios, such as deterministic models, known diffusion, discrete systems, one-dimensional dynamics, or systems constrained by strong structural assumptions such as linearity. This work proposes a novel method for estimating both drift and diffusion coefficients of continuous, multidimensional, nonlinear controlled stochastic differential equations with non-uniform diffusion. We assume regularity of the coefficients within a Sobolev space, allowing for broad applicability to various dynamical systems in robotics, finance, climate modeling, and biology. Leveraging the Fokker-Planck equation, we split the estimation into two tasks: (a) estimating system dynamics for a finite set of controls, and (b) estimating coefficients that govern those dynamics. We provide strong theoretical guarantees, including finite-sample bounds for \(L^2\), \(L^\infty\), and risk metrics, with learning rates adaptive to coefficients' regularity, similar to those in nonparametric least-squares regression literature. The practical effectiveness of our approach is demonstrated through extensive numerical experiments. Our method is available as an open-source Python library.

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Probabilistic embeddings have several advantages over deterministic embeddings as they map each data point to a distribution, which better describes the uncertainty and complexity of data. Many works focus on adjusting the distribution constraint under the Information Bottleneck (IB) principle to enhance representation learning. However, these proposed regularization terms only consider the constraint of each latent variable, omitting the structural information between latent variables. In this paper, we propose a novel structural entropy-guided probabilistic coding model, named SEPC. Specifically, we incorporate the relationship between latent variables into the optimization by proposing a structural entropy regularization loss. Besides, as traditional structural information theory is not well-suited for regression tasks, we propose a probabilistic encoding tree, transferring regression tasks to classification tasks while diminishing the influence of the transformation. Experimental results across 12 natural language understanding tasks, including both classification and regression tasks, demonstrate the superior performance of SEPC compared to other state-of-the-art models in terms of effectiveness, generalization capability, and robustness to label noise. The codes and datasets are available at //github.com/SELGroup/SEPC.

Noisy matrix completion has attracted significant attention due to its applications in recommendation systems, signal processing and image restoration. Most existing works rely on (weighted) least squares methods under various low-rank constraints. However, minimizing the sum of squared residuals is not always efficient, as it may ignore the potential structural information in the residuals.In this study, we propose a novel residual spectral matching criterion that incorporates not only the numerical but also locational information of residuals. This criterion is the first in noisy matrix completion to adopt the perspective of low-rank perturbation of random matrices and exploit the spectral properties of sparse random matrices. We derive optimal statistical properties by analyzing the spectral properties of sparse random matrices and bounding the effects of low-rank perturbations and partial observations. Additionally, we propose algorithms that efficiently approximate solutions by constructing easily computable pseudo-gradients. The iterative process of the proposed algorithms ensures convergence at a rate consistent with the optimal statistical error bound. Our method and algorithms demonstrate improved numerical performance in both simulated and real data examples, particularly in environments with high noise levels.

We study conditions under which transformers using soft attention can simulate hard attention, that is, effectively focus all attention on a subset of positions. First, we examine several variants of linear temporal logic, whose formulas have been previously been shown to be computable using hard attention transformers. We demonstrate how soft attention transformers can compute formulas of these logics using unbounded positional embeddings or temperature scaling. Second, we demonstrate how temperature scaling allows softmax transformers to simulate a large subclass of average-hard attention transformers, those that have what we call the uniform-tieless property.

Constructing sparse, effective reduced-order models (ROMs) for high-dimensional dynamical data is an active area of research in applied sciences. In this work, we study an efficient approach to identifying such sparse ROMs using an information-theoretic indicator called causation entropy. Given a feature library of possible building block terms for the sought ROMs, the causation entropy ranks the importance of each term to the dynamics conveyed by the training data before a parameter estimation procedure is performed. It thus allows for an efficient construction of a hierarchy of ROMs with varying degrees of sparsity to effectively handle different tasks. This article examines the ability of the causation entropy to identify skillful sparse ROMs when a relatively high-dimensional ROM is required to emulate the dynamics conveyed by the training dataset. We demonstrate that a Gaussian approximation of the causation entropy still performs exceptionally well even in presence of highly non-Gaussian statistics. Such approximations provide an efficient way to access the otherwise hard to compute causation entropies when the selected feature library contains a large number of candidate functions. Besides recovering long-term statistics, we also demonstrate good performance of the obtained ROMs in recovering unobserved dynamics via data assimilation with partial observations, a test that has not been done before for causation-based ROMs of partial differential equations. The paradigmatic Kuramoto-Sivashinsky equation placed in a chaotic regime with highly skewed, multimodal statistics is utilized for these purposes.

In the field of machine unlearning, certified unlearning has been extensively studied in convex machine learning models due to its high efficiency and strong theoretical guarantees. However, its application to deep neural networks (DNNs), known for their highly nonconvex nature, still poses challenges. To bridge the gap between certified unlearning and DNNs, we propose several simple techniques to extend certified unlearning methods to nonconvex objectives. To reduce the time complexity, we develop an efficient computation method by inverse Hessian approximation without compromising certification guarantees. In addition, we extend our discussion of certification to nonconvergence training and sequential unlearning, considering that real-world users can send unlearning requests at different time points. Extensive experiments on three real-world datasets demonstrate the efficacy of our method and the advantages of certified unlearning in DNNs.

Data generation is a fundamental research problem in data management due to its diverse use cases, ranging from testing database engines to data-specific applications. However, real-world entities often involve complex interactions that cannot be effectively modeled by traditional tabular data. Therefore, graph data generation has attracted increasing attention recently. Although various graph generators have been proposed in the literature, there are three limitations: i) They cannot capture the co-evolution pattern of graph structure and node attributes. ii) Few of them consider edge direction, leading to substantial information loss. iii) Current state-of-the-art dynamic graph generators are based on the temporal random walk, making the simulation process time-consuming. To fill the research gap, we introduce VRDAG, a novel variational recurrent framework for efficient dynamic attributed graph generation. Specifically, we design a bidirectional message-passing mechanism to encode both directed structural knowledge and attribute information of a snapshot. Then, the temporal dependency in the graph sequence is captured by a recurrence state updater, generating embeddings that can preserve the evolution pattern of early graphs. Based on the hidden node embeddings, a conditional variational Bayesian method is developed to sample latent random variables at the neighboring timestep for new snapshot generation. The proposed generation paradigm avoids the time-consuming path sampling and merging process in existing random walk-based methods, significantly reducing the synthesis time. Finally, comprehensive experiments on real-world datasets are conducted to demonstrate the effectiveness and efficiency of the proposed model.

Gradient attacks and data poisoning tamper with the training of machine learning algorithms to maliciously alter them and have been proven to be equivalent in convex settings. The extent of harm these attacks can produce in non-convex settings is still to be determined. Gradient attacks can affect far less systems than data poisoning but have been argued to be more harmful since they can be arbitrary, whereas data poisoning reduces the attacker's power to only being able to inject data points to training sets, via e.g. legitimate participation in a collaborative dataset. This raises the question of whether the harm made by gradient attacks can be matched by data poisoning in non-convex settings. In this work, we provide a positive answer in a worst-case scenario and show how data poisoning can mimic a gradient attack to perform an availability attack on (non-convex) neural networks. Through gradient inversion, commonly used to reconstruct data points from actual gradients, we show how reconstructing data points out of malicious gradients can be sufficient to perform a range of attacks. This allows us to show, for the first time, an availability attack on neural networks through data poisoning, that degrades the model's performances to random-level through a minority (as low as 1%) of poisoned points.

The conjoining of dynamical systems and deep learning has become a topic of great interest. In particular, neural differential equations (NDEs) demonstrate that neural networks and differential equation are two sides of the same coin. Traditional parameterised differential equations are a special case. Many popular neural network architectures, such as residual networks and recurrent networks, are discretisations. NDEs are suitable for tackling generative problems, dynamical systems, and time series (particularly in physics, finance, ...) and are thus of interest to both modern machine learning and traditional mathematical modelling. NDEs offer high-capacity function approximation, strong priors on model space, the ability to handle irregular data, memory efficiency, and a wealth of available theory on both sides. This doctoral thesis provides an in-depth survey of the field. Topics include: neural ordinary differential equations (e.g. for hybrid neural/mechanistic modelling of physical systems); neural controlled differential equations (e.g. for learning functions of irregular time series); and neural stochastic differential equations (e.g. to produce generative models capable of representing complex stochastic dynamics, or sampling from complex high-dimensional distributions). Further topics include: numerical methods for NDEs (e.g. reversible differential equations solvers, backpropagation through differential equations, Brownian reconstruction); symbolic regression for dynamical systems (e.g. via regularised evolution); and deep implicit models (e.g. deep equilibrium models, differentiable optimisation). We anticipate this thesis will be of interest to anyone interested in the marriage of deep learning with dynamical systems, and hope it will provide a useful reference for the current state of the art.

The aim of this work is to develop a fully-distributed algorithmic framework for training graph convolutional networks (GCNs). The proposed method is able to exploit the meaningful relational structure of the input data, which are collected by a set of agents that communicate over a sparse network topology. After formulating the centralized GCN training problem, we first show how to make inference in a distributed scenario where the underlying data graph is split among different agents. Then, we propose a distributed gradient descent procedure to solve the GCN training problem. The resulting model distributes computation along three lines: during inference, during back-propagation, and during optimization. Convergence to stationary solutions of the GCN training problem is also established under mild conditions. Finally, we propose an optimization criterion to design the communication topology between agents in order to match with the graph describing data relationships. A wide set of numerical results validate our proposal. To the best of our knowledge, this is the first work combining graph convolutional neural networks with distributed optimization.

We introduce an approach for deep reinforcement learning (RL) that improves upon the efficiency, generalization capacity, and interpretability of conventional approaches through structured perception and relational reasoning. It uses self-attention to iteratively reason about the relations between entities in a scene and to guide a model-free policy. Our results show that in a novel navigation and planning task called Box-World, our agent finds interpretable solutions that improve upon baselines in terms of sample complexity, ability to generalize to more complex scenes than experienced during training, and overall performance. In the StarCraft II Learning Environment, our agent achieves state-of-the-art performance on six mini-games -- surpassing human grandmaster performance on four. By considering architectural inductive biases, our work opens new directions for overcoming important, but stubborn, challenges in deep RL.

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