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Studying the properties of stochastic noise to optimize complex non-convex functions has been an active area of research in the field of machine learning. Prior work has shown that the noise of stochastic gradient descent improves optimization by overcoming undesirable obstacles in the landscape. Moreover, injecting artificial Gaussian noise has become a popular idea to quickly escape saddle points. Indeed, in the absence of reliable gradient information, the noise is used to explore the landscape, but it is unclear what type of noise is optimal in terms of exploration ability. In order to narrow this gap in our knowledge, we study a general type of continuous-time non-Markovian process, based on fractional Brownian motion, that allows for the increments of the process to be correlated. This generalizes processes based on Brownian motion, such as the Ornstein-Uhlenbeck process. We demonstrate how to discretize such processes which gives rise to the new algorithm fPGD. This method is a generalization of the known algorithms PGD and Anti-PGD. We study the properties of fPGD both theoretically and empirically, demonstrating that it possesses exploration abilities that, in some cases, are favorable over PGD and Anti-PGD. These results open the field to novel ways to exploit noise for training machine learning models.

We study the problem of unbiased estimation of expectations with respect to (w.r.t.) $\pi$ a given, general probability measure on $(\mathbb{R}^d,\mathcal{B}(\mathbb{R}^d))$ that is absolutely continuous with respect to a standard Gaussian measure. We focus on simulation associated to a particular class of diffusion processes, sometimes termed the Schr\"odinger-F\"ollmer Sampler, which is a simulation technique that approximates the law of a particular diffusion bridge process $\{X_t\}_{t\in [0,1]}$ on $\mathbb{R}^d$, $d\in \mathbb{N}_0$. This latter process is constructed such that, starting at $X_0=0$, one has $X_1\sim \pi$. Typically, the drift of the diffusion is intractable and, even if it were not, exact sampling of the associated diffusion is not possible. As a result, \cite{sf_orig,jiao} consider a stochastic Euler-Maruyama scheme that allows the development of biased estimators for expectations w.r.t.~$\pi$. We show that for this methodology to achieve a mean square error of $\mathcal{O}(\epsilon^2)$, for arbitrary $\epsilon>0$, the associated cost is $\mathcal{O}(\epsilon^{-5})$. We then introduce an alternative approach that provides unbiased estimates of expectations w.r.t.~$\pi$, that is, it does not suffer from the time discretization bias or the bias related with the approximation of the drift function. We prove that to achieve a mean square error of $\mathcal{O}(\epsilon^2)$, the associated cost is, with high probability, $\mathcal{O}(\epsilon^{-2}|\log(\epsilon)|^{2+\delta})$, for any $\delta>0$. We implement our method on several examples including Bayesian inverse problems.

In this paper, we propose a new covering technique localized for the trajectories of SGD. This localization provides an algorithm-specific complexity measured by the covering number, which can have dimension-independent cardinality in contrast to standard uniform covering arguments that result in exponential dimension dependency. Based on this localized construction, we show that if the objective function is a finite perturbation of a piecewise strongly convex and smooth function with $P$ pieces, i.e. non-convex and non-smooth in general, the generalization error can be upper bounded by $O(\sqrt{(\log n\log(nP))/n})$, where $n$ is the number of data samples. In particular, this rate is independent of dimension and does not require early stopping and decaying step size. Finally, we employ these results in various contexts and derive generalization bounds for multi-index linear models, multi-class support vector machines, and $K$-means clustering for both hard and soft label setups, improving the known state-of-the-art rates.

In the history of first-order algorithms, Nesterov's accelerated gradient descent (NAG) is one of the milestones. However, the cause of the acceleration has been a mystery for a long time. It has not been revealed with the existence of gradient correction until the high-resolution differential equation framework proposed in [Shi et al., 2021]. In this paper, we continue to investigate the acceleration phenomenon. First, we provide a significantly simplified proof based on precise observation and a tighter inequality for $L$-smooth functions. Then, a new implicit-velocity high-resolution differential equation framework, as well as the corresponding implicit-velocity version of phase-space representation and Lyapunov function, is proposed to investigate the convergence behavior of the iterative sequence $\{x_k\}_{k=0}^{\infty}$ of NAG. Furthermore, from two kinds of phase-space representations, we find that the role played by gradient correction is equivalent to that by velocity included implicitly in the gradient, where the only difference comes from the iterative sequence $\{y_{k}\}_{k=0}^{\infty}$ replaced by $\{x_k\}_{k=0}^{\infty}$. Finally, for the open question of whether the gradient norm minimization of NAG has a faster rate $o(1/k^3)$, we figure out a positive answer with its proof. Meanwhile, a faster rate of objective value minimization $o(1/k^2)$ is shown for the case $r > 2$.

We construct quantum algorithms to compute the solution and/or physical observables of nonlinear ordinary differential equations (ODEs) and nonlinear Hamilton-Jacobi equations (HJE) via linear representations or exact mappings between nonlinear ODEs/HJE and linear partial differential equations (the Liouville equation and the Koopman-von Neumann equation). The connection between the linear representations and the original nonlinear system is established through the Dirac delta function or the level set mechanism. We compare the quantum linear systems algorithms based methods and the quantum simulation methods arising from different numerical approximations, including the finite difference discretisations and the Fourier spectral discretisations for the two different linear representations, with the result showing that the quantum simulation methods usually give the best performance in time complexity. We also propose the Schr\"odinger framework to solve the Liouville equation for the HJE, since it can be recast as the semiclassical limit of the Wigner transform of the Schr\"odinger equation. Comparsion between the Schr\"odinger and the Liouville framework will also be made.

State estimation is an important aspect in many robotics applications. In this work, we consider the task of obtaining accurate state estimates for robotic systems by enhancing the dynamics model used in state estimation algorithms. Existing frameworks such as moving horizon estimation (MHE) and the unscented Kalman filter (UKF) provide the flexibility to incorporate nonlinear dynamics and measurement models. However, this implies that the dynamics model within these algorithms has to be sufficiently accurate in order to warrant the accuracy of the state estimates. To enhance the dynamics models and improve the estimation accuracy, we utilize a deep learning framework known as knowledge-based neural ordinary differential equations (KNODEs). The KNODE framework embeds prior knowledge into the training procedure and synthesizes an accurate hybrid model by fusing a prior first-principles model with a neural ordinary differential equation (NODE) model. In our proposed LEARNEST framework, we integrate the data-driven model into two novel model-based state estimation algorithms, which are denoted as KNODE-MHE and KNODE-UKF. These two algorithms are compared against their conventional counterparts across a number of robotic applications; state estimation for a cartpole system using partial measurements, localization for a ground robot, as well as state estimation for a quadrotor. Through simulations and tests using real-world experimental data, we demonstrate the versatility and efficacy of the proposed learning-enhanced state estimation framework.

Asymptotic study on the partition function $p(n)$ began with the work of Hardy and Ramanujan. Later Rademacher obtained a convergent series for $p(n)$ and an error bound was given by Lehmer. Despite having this, a full asymptotic expansion for $p(n)$ with an explicit error bound is not known. Recently O'Sullivan studied the asymptotic expansion of $p^{k}(n)$-partitions into $k$th powers, initiated by Wright, and consequently obtained an asymptotic expansion for $p(n)$ along with a concise description of the coefficients involved in the expansion but without any estimation of the error term. Here we consider a detailed and comprehensive analysis on an estimation of the error term obtained by truncating the asymptotic expansion for $p(n)$ at any positive integer $n$. This gives rise to an infinite family of inequalities for $p(n)$ which finally answers to a question proposed by Chen. Our error term estimation predominantly relies on applications of algorithmic methods from symbolic summation.

We consider the stochastic gradient descent (SGD) algorithm driven by a general stochastic sequence, including i.i.d noise and random walk on an arbitrary graph, among others; and analyze it in the asymptotic sense. Specifically, we employ the notion of `efficiency ordering', a well-analyzed tool for comparing the performance of Markov Chain Monte Carlo (MCMC) samplers, for SGD algorithms in the form of Loewner ordering of covariance matrices associated with the scaled iterate errors in the long term. Using this ordering, we show that input sequences that are more efficient for MCMC sampling also lead to smaller covariance of the errors for SGD algorithms in the limit. This also suggests that an arbitrarily weighted MSE of SGD iterates in the limit becomes smaller when driven by more efficient chains. Our finding is of particular interest in applications such as decentralized optimization and swarm learning, where SGD is implemented in a random walk fashion on the underlying communication graph for cost issues and/or data privacy. We demonstrate how certain non-Markovian processes, for which typical mixing-time based non-asymptotic bounds are intractable, can outperform their Markovian counterparts in the sense of efficiency ordering for SGD. We show the utility of our method by applying it to gradient descent with shuffling and mini-batch gradient descent, reaffirming key results from existing literature under a unified framework. Empirically, we also observe efficiency ordering for variants of SGD such as accelerated SGD and Adam, open up the possibility of extending our notion of efficiency ordering to a broader family of stochastic optimization algorithms.

We study differentially private (DP) stochastic optimization (SO) with data containing outliers and loss functions that are not Lipschitz continuous. To date, the vast majority of work on DP SO assumes that the loss is Lipschitz (i.e. stochastic gradients are uniformly bounded), and their error bounds scale with the Lipschitz parameter of the loss. While this assumption is convenient, it is often unrealistic: in many practical problems where privacy is required, data may contain outliers or be unbounded, causing some stochastic gradients to have large norm. In such cases, the Lipschitz parameter may be prohibitively large, leading to vacuous excess risk bounds. Thus, building on a recent line of work [WXDX20, KLZ22], we make the weaker assumption that stochastic gradients have bounded $k$-th moments for some $k \geq 2$. Compared with works on DP Lipschitz SO, our excess risk scales with the $k$-th moment bound instead of the Lipschitz parameter of the loss, allowing for significantly faster rates in the presence of outliers. For convex and strongly convex loss functions, we provide the first asymptotically optimal excess risk bounds (up to a logarithmic factor). Moreover, in contrast to the prior works [WXDX20, KLZ22], our bounds do not require the loss function to be differentiable/smooth. We also devise an accelerated algorithm that runs in linear time and yields improved (compared to prior works) and nearly optimal excess risk for smooth losses. Additionally, our work is the first to address non-convex non-Lipschitz loss functions satisfying the Proximal-PL inequality; this covers some classes of neural nets, among other practical models. Our Proximal-PL algorithm has nearly optimal excess risk that almost matches the strongly convex lower bound. Lastly, we provide shuffle DP variations of our algorithms, which do not require a trusted curator (e.g. for distributed learning).

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.