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Deep neural networks have emerged as the workhorse for a large section of robotics and control applications, especially as models for dynamical systems. Such data-driven models are in turn used for designing and verifying autonomous systems. This is particularly useful in modeling medical systems where data can be leveraged to individualize treatment. In safety-critical applications, it is important that the data-driven model is conformant to established knowledge from the natural sciences. Such knowledge is often available or can often be distilled into a (possibly black-box) model $M$. For instance, the unicycle model for an F1 racing car. In this light, we consider the following problem - given a model $M$ and state transition dataset, we wish to best approximate the system model while being bounded distance away from $M$. We propose a method to guarantee this conformance. Our first step is to distill the dataset into few representative samples called memories, using the idea of a growing neural gas. Next, using these memories we partition the state space into disjoint subsets and compute bounds that should be respected by the neural network, when the input is drawn from a particular subset. This serves as a symbolic wrapper for guaranteed conformance. We argue theoretically that this only leads to bounded increase in approximation error; which can be controlled by increasing the number of memories. We experimentally show that on three case studies (Car Model, Drones, and Artificial Pancreas), our constrained neurosymbolic models conform to specified $M$ models (each encoding various constraints) with order-of-magnitude improvements compared to the augmented Lagrangian and vanilla training methods.

We study the expressibility and learnability of convex optimization solution functions and their multi-layer architectural extension. The main results are: \emph{(1)} the class of solution functions of linear programming (LP) and quadratic programming (QP) is a universal approximant for the $C^k$ smooth model class or some restricted Sobolev space, and we characterize the rate-distortion, \emph{(2)} the approximation power is investigated through a viewpoint of regression error, where information about the target function is provided in terms of data observations, \emph{(3)} compositionality in the form of a deep architecture with optimization as a layer is shown to reconstruct some basic functions used in numerical analysis without error, which implies that \emph{(4)} a substantial reduction in rate-distortion can be achieved with a universal network architecture, and \emph{(5)} we discuss the statistical bounds of empirical covering numbers for LP/QP, as well as a generic optimization problem (possibly nonconvex) by exploiting tame geometry. Our results provide the \emph{first rigorous analysis of the approximation and learning-theoretic properties of solution functions} with implications for algorithmic design and performance guarantees.

Most common Optimal Transport (OT) solvers are currently based on an approximation of underlying measures by discrete measures. However, it is sometimes relevant to work only with moments of measures instead of the measure itself, and many common OT problems can be formulated as moment problems (the most relevant examples being $L^p$-Wasserstein distances, barycenters, and Gromov-Wasserstein discrepancies on Euclidean spaces). We leverage this fact to develop a generalized moment formulation that covers these classes of OT problems. The transport plan is represented through its moments on a given basis, and the marginal constraints are expressed in terms of moment constraints. A practical computation then consists in considering a truncation of the involved moment sequences up to a certain order, and using the polynomial sums-of-squares hierarchy for measures supported on semi-algebraic sets. We prove that the strategy converges to the solution of the OT problem as the order increases. We also show how to approximate linear quantities of interest, and how to estimate the support of the optimal transport map from the computed moments using Christoffel-Darboux kernels. Numerical experiments illustrate the good behavior of the approach.

We establish a simple connection between robust and differentially-private algorithms: private mechanisms which perform well with very high probability are automatically robust in the sense that they retain accuracy even if a constant fraction of the samples they receive are adversarially corrupted. Since optimal mechanisms typically achieve these high success probabilities, our results imply that optimal private mechanisms for many basic statistics problems are robust. We investigate the consequences of this observation for both algorithms and computational complexity across different statistical problems. Assuming the Brennan-Bresler secret-leakage planted clique conjecture, we demonstrate a fundamental tradeoff between computational efficiency, privacy leakage, and success probability for sparse mean estimation. Private algorithms which match this tradeoff are not yet known -- we achieve that (up to polylogarithmic factors) in a polynomially-large range of parameters via the Sum-of-Squares method. To establish an information-computation gap for private sparse mean estimation, we also design new (exponential-time) mechanisms using fewer samples than efficient algorithms must use. Finally, we give evidence for privacy-induced information-computation gaps for several other statistics and learning problems, including PAC learning parity functions and estimation of the mean of a multivariate Gaussian.

Computing empirical Wasserstein distance in the independence test is an optimal transport (OT) problem with a special structure. This observation inspires us to study a special type of OT problem and propose a modified Hungarian algorithm to solve it exactly. For an OT problem involving two marginals with $m$ and $n$ atoms ($m\geq n$), respectively, the computational complexity of the proposed algorithm is $O(m^2n)$. Computing the empirical Wasserstein distance in the independence test requires solving this special type of OT problem, where $m=n^2$. The associated computational complexity of the proposed algorithm is $O(n^5)$, while the order of applying the classic Hungarian algorithm is $O(n^6)$. In addition to the aforementioned special type of OT problem, it is shown that the modified Hungarian algorithm could be adopted to solve a wider range of OT problems. Broader applications of the proposed algorithm are discussed -- solving the one-to-many and the many-to-many assignment problems. Numerical experiments are conducted to validate our theoretical results. The experiment results demonstrate that the proposed modified Hungarian algorithm compares favorably with the Hungarian algorithm and the well-known Sinkhorn algorithm.

This paper proposes embedded Gaussian Process Barrier States (GP-BaS), a methodology to safely control unmodeled dynamics of nonlinear system using Bayesian learning. Gaussian Processes (GPs) are used to model the dynamics of the safety-critical system, which is subsequently used in the GP-BaS model. We derive the barrier state dynamics utilizing the GP posterior, which is used to construct a safety embedded Gaussian process dynamical model (GPDM). We show that the safety-critical system can be controlled to remain inside the safe region as long as we can design a controller that renders the BaS-GPDM's trajectories bounded (or asymptotically stable). The proposed approach overcomes various limitations in early attempts at combining GPs with barrier functions due to the abstention of restrictive assumptions such as linearity of the system with respect to control, relative degree of the constraints and number or nature of constraints. This work is implemented on various examples for trajectory optimization and control including optimal stabilization of unstable linear system and safe trajectory optimization of a Dubins vehicle navigating through an obstacle course and on a quadrotor in an obstacle avoidance task using GP differentiable dynamic programming (GP-DDP). The proposed framework is capable of maintaining safe optimization and control of unmodeled dynamics and is purely data driven.

Efficient motion planning algorithms are of central importance for deploying robots in the real world. Unfortunately, these algorithms often drastically reduce the dimensionality of the problem for the sake of feasibility, thereby foregoing optimal solutions. This limitation is most readily observed in agile robots, where the solution space can have multiple additional dimensions. Optimal control approaches partially solve this problem by finding optimal solutions without sacrificing the complexity of the environment, but do not meet the efficiency demands of real-world applications. This work proposes an approach to resolve these issues simultaneously by training a machine learning model on the outputs of an optimal control approach.

Reinforcement learning (RL) problems over general state and action spaces are notoriously challenging. In contrast to the tableau setting, one can not enumerate all the states and then iteratively update the policies for each state. This prevents the application of many well-studied RL methods especially those with provable convergence guarantees. In this paper, we first present a substantial generalization of the recently developed policy mirror descent method to deal with general state and action spaces. We introduce new approaches to incorporate function approximation into this method, so that we do not need to use explicit policy parameterization at all. Moreover, we present a novel policy dual averaging method for which possibly simpler function approximation techniques can be applied. We establish linear convergence rate to global optimality or sublinear convergence to stationarity for these methods applied to solve different classes of RL problems under exact policy evaluation. We then define proper notions of the approximation errors for policy evaluation and investigate their impact on the convergence of these methods applied to general-state RL problems with either finite-action or continuous-action spaces. To the best of our knowledge, the development of these algorithmic frameworks as well as their convergence analysis appear to be new in the literature.

Mixed-Integer Linear Programming (MILP) plays an important role across a range of scientific disciplines and within areas of strategic importance to society. The MILP problems, however, suffer from combinatorial complexity. Because of integer decision variables, as the problem size increases, the number of possible solutions increases super-linearly thereby leading to a drastic increase in the computational effort. To efficiently solve MILP problems, a "price-based" decomposition and coordination approach is developed to exploit 1. the super-linear reduction of complexity upon the decomposition and 2. the geometric convergence potential inherent to Polyak's stepsizing formula for the fastest coordination possible to obtain near-optimal solutions in a computationally efficient manner. Unlike all previous methods to set stepsizes heuristically by adjusting hyperparameters, the key novel way to obtain stepsizes is purely decision-based: a novel "auxiliary" constraint satisfaction problem is solved, from which the appropriate stepsizes are inferred. Testing results for large-scale Generalized Assignment Problems (GAP) demonstrate that for the majority of instances, certifiably optimal solutions are obtained. For stochastic job-shop scheduling as well as for pharmaceutical scheduling, computational results demonstrate the two orders of magnitude speedup as compared to Branch-and-Cut (B&C). The new method has a major impact on the efficient resolution of complex Mixed-Integer Programming (MIP) problems arising within a variety of scientific fields.

This paper presents a subsampling-task paradigm for data-driven task-specific experiment design (ED) and a novel method in populationwide supervised feature selection (FS). Optimal ED, the choice of sampling points under constraints of limited acquisition-time, arises in a wide variety of scientific and engineering contexts. However the continuous optimization used in classical approaches depend on a-priori parameter choices and challenging non-convex optimization landscapes. This paper proposes to replace this strategy with a subsampling-task paradigm, analogous to populationwide supervised FS. In particular, we introduce JOFSTO, which performs JOint Feature Selection and Task Optimization. JOFSTO jointly optimizes two coupled networks: one for feature scoring, which provides the ED, the other for execution of a downstream task or process. Unlike most FS problems, e.g. selecting protein expressions for classification, ED problems typically select from highly correlated globally informative candidates rather than seeking a small number of highly informative features among many uninformative features. JOFSTO's construction efficiently identifies potentially correlated, but effective subsets and returns a trained task network. We demonstrate the approach using parameter estimation and mapping problems in clinically-relevant applications in quantitative MRI and in hyperspectral imaging. Results from simulations and empirical data show the subsampling-task paradigm strongly outperforms classical ED, and within our paradigm, JOFSTO outperforms state-of-the-art supervised FS techniques. JOFSTO extends immediately to wider image-based ED problems and other scenarios where the design must be specified globally across large numbers of acquisitions. Code will be released.