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Behavioural metrics provide a quantitative refinement of classical two-valued behavioural equivalences on systems with quantitative data, such as metric or probabilistic transition systems. In analogy to the linear-time/branching-time spectrum of two-valued behavioural equivalences on transition systems, behavioural metrics vary in granularity. We provide a unifying treatment of spectra of behavioural metrics in the emerging framework of graded monads, working in coalgebraic generality, that is, parametrically in the system type. In the ensuing development of quantitative graded semantics, we introduce algebraic presentations of graded monads on the category of metric spaces. Moreover, we obtain a canonical generic notion of invariant real-valued modal logic, and provide criteria for such logics to be expressive in the sense that logical distance coincides with behavioural distance. We present positive examples based on this criterion, covering both known and new expressiveness results; in particular, we show that expressiveness holds essentially always for Eilenberg-Moore type trace semantics, and we obtain a new expressiveness result for trace semantics of fuzzy transition systems. As a negative result, we show that trace distance on probabilistic metric transition systems does not admit any characteristic real-valued modal logic, even in a more broadly understood sense.

We study the sample complexity of obtaining an $\epsilon$-optimal policy in \emph{Robust} discounted Markov Decision Processes (RMDPs), given only access to a generative model of the nominal kernel. This problem is widely studied in the non-robust case, and it is known that any planning approach applied to an empirical MDP estimated with $\tilde{\mathcal{O}}(\frac{H^3 \mid S \mid\mid A \mid}{\epsilon^2})$ samples provides an $\epsilon$-optimal policy, which is minimax optimal. Results in the robust case are much more scarce. For $sa$- (resp $s$-)rectangular uncertainty sets, the best known sample complexity is $\tilde{\mathcal{O}}(\frac{H^4 \mid S \mid^2\mid A \mid}{\epsilon^2})$ (resp. $\tilde{\mathcal{O}}(\frac{H^4 \mid S \mid^2\mid A \mid^2}{\epsilon^2})$), for specific algorithms and when the uncertainty set is based on the total variation (TV), the KL or the Chi-square divergences. In this paper, we consider uncertainty sets defined with an $L_p$-ball (recovering the TV case), and study the sample complexity of \emph{any} planning algorithm (with high accuracy guarantee on the solution) applied to an empirical RMDP estimated using the generative model. In the general case, we prove a sample complexity of $\tilde{\mathcal{O}}(\frac{H^4 \mid S \mid\mid A \mid}{\epsilon^2})$ for both the $sa$- and $s$-rectangular cases (improvements of $\mid S \mid$ and $\mid S \mid\mid A \mid$ respectively). When the size of the uncertainty is small enough, we improve the sample complexity to $\tilde{\mathcal{O}}(\frac{H^3 \mid S \mid\mid A \mid }{\epsilon^2})$, recovering the lower-bound for the non-robust case for the first time and a robust lower-bound when the size of the uncertainty is small enough.

We study the following characterization problem. Given a set $T$ of terminals and a $(2^{|T|}-2)$-dimensional vector $\pi$ whose coordinates are indexed by proper subsets of $T$, is there a graph $G$ that contains $T$, such that for all subsets $\emptyset\subsetneq S\subsetneq T$, $\pi_S$ equals the value of the min-cut in $G$ separating $S$ from $T\setminus S$? The only known necessary conditions are submodularity and a special class of linear inequalities given by Chaudhuri, Subrahmanyam, Wagner and Zaroliagis. Our main result is a new class of linear inequalities concerning laminar families, that generalize all previous ones. Using our new class of inequalities, we can generalize Karger's approximate min-cut counting result to graphs with terminals.

We study the expressivity of ReLU neural networks in the setting of a binary classification problem from a topological perspective. Recently, empirical studies showed that neural networks operate by changing topology, transforming a topologically complicated data set into a topologically simpler one as it passes through the layers. This topological simplification has been measured by Betti numbers, which are algebraic invariants of a topological space. We use the same measure to establish lower and upper bounds on the topological simplification a ReLU neural network can achieve with a given architecture. We therefore contribute to a better understanding of the expressivity of ReLU neural networks in the context of binary classification problems by shedding light on their ability to capture the underlying topological structure of the data. In particular the results show that deep ReLU neural networks are exponentially more powerful than shallow ones in terms of topological simplification. This provides a mathematically rigorous explanation why deeper networks are better equipped to handle complex and topologically rich datasets.

We consider a simple setting in neuroevolution where an evolutionary algorithm optimizes the weights and activation functions of a simple artificial neural network. We then define simple example functions to be learned by the network and conduct rigorous runtime analyses for networks with a single neuron and for a more advanced structure with several neurons and two layers. Our results show that the proposed algorithm is generally efficient on two example problems designed for one neuron and efficient with at least constant probability on the example problem for a two-layer network. In particular, the so-called harmonic mutation operator choosing steps of size $j$ with probability proportional to $1/j$ turns out as a good choice for the underlying search space. However, for the case of one neuron, we also identify situations with hard-to-overcome local optima. Experimental investigations of our neuroevolutionary algorithm and a state-of-the-art CMA-ES support the theoretical findings.

Neural collapse provides an elegant mathematical characterization of learned last layer representations (a.k.a. features) and classifier weights in deep classification models. Such results not only provide insights but also motivate new techniques for improving practical deep models. However, most of the existing empirical and theoretical studies in neural collapse focus on the case that the number of classes is small relative to the dimension of the feature space. This paper extends neural collapse to cases where the number of classes are much larger than the dimension of feature space, which broadly occur for language models, retrieval systems, and face recognition applications. We show that the features and classifier exhibit a generalized neural collapse phenomenon, where the minimum one-vs-rest margins is maximized.We provide empirical study to verify the occurrence of generalized neural collapse in practical deep neural networks. Moreover, we provide theoretical study to show that the generalized neural collapse provably occurs under unconstrained feature model with spherical constraint, under certain technical conditions on feature dimension and number of classes.

According to the classic Chv{\'{a}}tal's Lemma from 1977, a graph of minimum degree $\delta(G)$ contains every tree on $\delta(G)+1$ vertices. Our main result is the following algorithmic "extension" of Chv\'{a}tal's Lemma: For any $n$-vertex graph $G$, integer $k$, and a tree $T$ on at most $\delta(G)+k$ vertices, deciding whether $G$ contains a subgraph isomorphic to $T$, can be done in time $f(k)\cdot n^{\mathcal{O}(1)}$ for some function $f$ of $k$ only. The proof of our main result is based on an interplay between extremal graph theory and parameterized algorithms.

We propose a volumetric formulation for computing the Optimal Transport problem defined on surfaces in $\mathbb{R}^3$, found in disciplines like optics, computer graphics, and computational methodologies. Instead of directly tackling the original problem on the surface, we define a new Optimal Transport problem on a thin tubular region, $T_{\epsilon}$, adjacent to the surface. This extension offers enhanced flexibility and simplicity for numerical discretization on Cartesian grids. The Optimal Transport mapping and potential function computed on $T_{\epsilon}$ are consistent with the original problem on surfaces. We demonstrate that, with the proposed volumetric approach, it is possible to use simple and straightforward numerical methods to solve Optimal Transport for $\Gamma = \mathbb{S}^2$.

Multivariate bounded discrete data arises in many fields. In the setting of longitudinal dementia studies, such data is collected when individuals complete neuropsychological tests. We outline a modeling and inference procedure that can model the joint distribution conditional on baseline covariates, leveraging previous work on mixtures of experts and latent class models. Furthermore, we illustrate how the work can be extended when the outcome data is missing at random using a nested EM algorithm. The proposed model can incorporate covariate information, perform imputation and clustering, and infer latent trajectories. We apply our model on simulated data and an Alzheimer's disease data set.

In the context of computer models, calibration is the process of estimating unknown simulator parameters from observational data. Calibration is variously referred to as model fitting, parameter estimation/inference, an inverse problem, and model tuning. The need for calibration occurs in most areas of science and engineering, and has been used to estimate hard to measure parameters in climate, cardiology, drug therapy response, hydrology, and many other disciplines. Although the statistical method used for calibration can vary substantially, the underlying approach is essentially the same and can be considered abstractly. In this survey, we review the decisions that need to be taken when calibrating a model, and discuss a range of computational methods that can be used to compute Bayesian posterior distributions.