Mathematical & Statistical Methods
A Systematization of the Wagner Framework: Graph Theory Conjectures and Reinforcement Learning
Angileri, Flora, Lombardi, Giulia, Fois, Andrea, Faraone, Renato, Metta, Carlo, Salvi, Michele, Bianchi, Luigi Amedeo, Fantozzi, Marco, Galfrè, Silvia Giulia, Pavesi, Daniele, Parton, Maurizio, Morandin, Francesco
In 2021, Adam Zsolt Wagner proposed an approach to disprove conjectures in graph theory using Reinforcement Learning (RL). Wagner's idea can be framed as follows: consider a conjecture, such as a certain quantity f(G) < 0 for every graph G; one can then play a single-player graph-building game, where at each turn the player decides whether to add an edge or not. The game ends when all edges have been considered, resulting in a certain graph G_T, and f(G_T) is the final score of the game; RL is then used to maximize this score. This brilliant idea is as simple as innovative, and it lends itself to systematic generalization. Several different single-player graph-building games can be employed, along with various RL algorithms. Moreover, RL maximizes the cumulative reward, allowing for step-by-step rewards instead of a single final score, provided the final cumulative reward represents the quantity of interest f(G_T). In this paper, we discuss these and various other choices that can be significant in Wagner's framework. As a contribution to this systematization, we present four distinct single-player graph-building games. Each game employs both a step-by-step reward system and a single final score. We also propose a principled approach to select the most suitable neural network architecture for any given conjecture, and introduce a new dataset of graphs labeled with their Laplacian spectra. Furthermore, we provide a counterexample for a conjecture regarding the sum of the matching number and the spectral radius, which is simpler than the example provided in Wagner's original paper. The games have been implemented as environments in the Gymnasium framework, and along with the dataset, are available as open-source supplementary materials.
Modeling and Controls of Fluid-Structure Interactions (FSI) in Dynamic Morphing Flight
Gupta, Bibek, Sihite, Eric, Ramezani, Alireza
The primary aim of this study is to enhance the accuracy of our aerodynamic Fluid-Structure Interaction (FSI) model to support the controlled tracking of 3D flight trajectories by Aerobat, which is a dynamic morphing winged drone. Building upon our previously documented Unsteady Aerodynamic model rooted in horseshoe vortices, we introduce a new iteration of Aerobat, labeled as version beta, which is designed for attachment to a Kinova arm. Through a series of experiments, we gather force-moment data from the robotic arm attachment and utilize it to fine-tune our unsteady model for banking turn maneuvers. Subsequently, we employ the tuned FSI model alongside a collocation control strategy to accomplish 3D banking turns of Aerobat within simulation environments. The primary contribution lies in presenting a methodical approach to calibrate our FSI model to predict complex 3D maneuvers and successfully assessing the model's potential for closed-loop flight control of Aerobat using an optimization-based collocation method.
Recent and Upcoming Developments in Randomized Numerical Linear Algebra for Machine Learning
Dereziński, Michał, Mahoney, Michael W.
Large matrices arise in many machine learning and data analysis applications, including as representations of datasets, graphs, model weights, and first and second-order derivatives. Randomized Numerical Linear Algebra (RandNLA) is an area which uses randomness to develop improved algorithms for ubiquitous matrix problems. The area has reached a certain level of maturity; but recent hardware trends, efforts to incorporate RandNLA algorithms into core numerical libraries, and advances in machine learning, statistics, and random matrix theory, have lead to new theoretical and practical challenges. This article provides a self-contained overview of RandNLA, in light of these developments.
On the Sequence Evaluation based on Stochastic Processes
Zhang, Tianhao, Lin, Zhexiao, Sheng, Zhecheng, Jiang, Chen, Kang, Dongyeop
Modeling and analyzing long sequences of text is an essential task for Natural Language Processing. Success in capturing long text dynamics using neural language models will facilitate many downstream tasks such as coherence evaluation, text generation, machine translation and so on. This paper presents a novel approach to model sequences through a stochastic process. We introduce a likelihood-based training objective for the text encoder and design a more thorough measurement (score) for long text evaluation compared to the previous approach. The proposed training objective effectively preserves the sequence coherence, while the new score comprehensively captures both temporal and spatial dependencies. Theoretical properties of our new score show its advantages in sequence evaluation. Experimental results show superior performance in various sequence evaluation tasks, including global and local discrimination within and between documents of different lengths. We also demonstrate the encoder achieves competitive results on discriminating human and AI written text.
Learning conditional distributions on continuous spaces
Bénézet, Cyril, Cheng, Ziteng, Jaimungal, Sebastian
We investigate sample-based learning of conditional distributions on multi-dimensional unit boxes, allowing for different dimensions of the feature and target spaces. Our approach involves clustering data near varying query points in the feature space to create empirical measures in the target space. We employ two distinct clustering schemes: one based on a fixed-radius ball and the other on nearest neighbors. We establish upper bounds for the convergence rates of both methods and, from these bounds, deduce optimal configurations for the radius and the number of neighbors. We propose to incorporate the nearest neighbors method into neural network training, as our empirical analysis indicates it has better performance in practice. For efficiency, our training process utilizes approximate nearest neighbors search with random binary space partitioning. Additionally, we employ the Sinkhorn algorithm and a sparsity-enforced transport plan. Our empirical findings demonstrate that, with a suitably designed structure, the neural network has the ability to adapt to a suitable level of Lipschitz continuity locally. For reproducibility, our code is available at \url{https://github.com/zcheng-a/LCD_kNN}.
Distributional MIPLIB: a Multi-Domain Library for Advancing ML-Guided MILP Methods
Huang, Weimin, Huang, Taoan, Ferber, Aaron M, Dilkina, Bistra
Mixed Integer Linear Programming (MILP) is a fundamental tool for modeling combinatorial optimization problems. Recently, a growing body of research has used machine learning to accelerate MILP solving. Despite the increasing popularity of this approach, there is a lack of a common repository that provides distributions of similar MILP instances across different domains, at different hardness levels, with standardized test sets. In this paper, we introduce Distributional MIPLIB, a multi-domain library of problem distributions for advancing ML-guided MILP methods. We curate MILP distributions from existing work in this area as well as real-world problems that have not been used, and classify them into different hardness levels. It will facilitate research in this area by enabling comprehensive evaluation on diverse and realistic domains. We empirically illustrate the benefits of using Distributional MIPLIB as a research vehicle in two ways. We evaluate the performance of ML-guided variable branching on previously unused distributions to identify potential areas for improvement. Moreover, we propose to learn branching policies from a mix of distributions, demonstrating that mixed distributions achieve better performance compared to homogeneous distributions when there is limited data and generalize well to larger instances.
Online Newton Method for Bandit Convex Optimisation
Fokkema, Hidde, van der Hoeven, Dirk, Lattimore, Tor, Mayo, Jack J.
We introduce a computationally efficient algorithm for zeroth-order bandit convex optimisation and prove that in the adversarial setting its regret is at most $d^{3.5} \sqrt{n} \mathrm{polylog}(n, d)$ with high probability where $d$ is the dimension and $n$ is the time horizon. In the stochastic setting the bound improves to $M d^{2} \sqrt{n} \mathrm{polylog}(n, d)$ where $M \in [d^{-1/2}, d^{-1 / 4}]$ is a constant that depends on the geometry of the constraint set and the desired computational properties.
Nonlinear time-series embedding by monotone variational inequality
In the wild, we often encounter collections of sequential data such as electrocardiograms, motion capture, genomes, and natural language, and sequences may be multichannel or symbolic with nonlinear dynamics. We introduce a new method to learn low-dimensional representations of nonlinear time series without supervision and can have provable recovery guarantees. The learned representation can be used for downstream machine-learning tasks such as clustering and classification. The method is based on the assumption that the observed sequences arise from a common domain, but each sequence obeys its own autoregressive models that are related to each other through low-rank regularization. We cast the problem as a computationally efficient convex matrix parameter recovery problem using monotone Variational Inequality and encode the common domain assumption via low-rank constraint across the learned representations, which can learn the geometry for the entire domain as well as faithful representations for the dynamics of each individual sequence using the domain information in totality. We show the competitive performance of our method on real-world time-series data with the baselines and demonstrate its effectiveness for symbolic text modeling and RNA sequence clustering.
Network two-sample test for block models
Nguen, Chung Kyong, Padilla, Oscar Hernan Madrid, Amini, Arash A.
We consider the two-sample testing problem for networks, where the goal is to determine whether two sets of networks originated from the same stochastic model. Assuming no vertex correspondence and allowing for different numbers of nodes, we address a fundamental network testing problem that goes beyond simple adjacency matrix comparisons. We adopt the stochastic block model (SBM) for network distributions, due to their interpretability and the potential to approximate more general models. The lack of meaningful node labels and vertex correspondence translate to a graph matching challenge when developing a test for SBMs. We introduce an efficient algorithm to match estimated network parameters, allowing us to properly combine and contrast information within and across samples, leading to a powerful test. We show that the matching algorithm, and the overall test are consistent, under mild conditions on the sparsity of the networks and the sample sizes, and derive a chi-squared asymptotic null distribution for the test. Through a mixture of theoretical insights and empirical validations, including experiments with both synthetic and real-world data, this study advances robust statistical inference for complex network data.
Information-Theoretic Thresholds for the Alignments of Partially Correlated Graphs
Huang, Dong, Song, Xianwen, Yang, Pengkun
This paper studies the problem of recovering the hidden vertex correspondence between two correlated random graphs. We propose the partially correlated Erd\H{o}s-R\'enyi graphs model, wherein a pair of induced subgraphs with a certain number are correlated. We investigate the information-theoretic thresholds for recovering the latent correlated subgraphs and the hidden vertex correspondence. We prove that there exists an optimal rate for partial recovery for the number of correlated nodes, above which one can correctly match a fraction of vertices and below which correctly matching any positive fraction is impossible, and we also derive an optimal rate for exact recovery. In the proof of possibility results, we propose correlated functional digraphs, which partition the edges of the intersection graph into two types of components, and bound the error probability by lower-order cumulant generating functions. The proof of impossibility results build upon the generalized Fano's inequality and the recovery thresholds settled in correlated Erd\H{o}s-R\'enyi graphs model.