Statistical Learning
Learning to Sample Better
Albergo, Michael S., Vanden-Eijnden, Eric
These lecture notes provide an introduction to recent advances in generative modeling methods based on the dynamical transportation of measures, by means of which samples from a simple base measure are mapped to samples from a target measure of interest. Special emphasis is put on the applications of these methods to Monte-Carlo (MC) sampling techniques, such as importance sampling and Markov Chain Monte-Carlo (MCMC) schemes. In this context, it is shown how the maps can be learned variationally using data generated by MC sampling, and how they can in turn be used to improve such sampling in a positive feedback loop.
Minimally Informed Linear Discriminant Analysis: training an LDA model with unlabelled data
Heintz, Nicolas, Francart, Tom, Bertrand, Alexander
Linear Discriminant Analysis (LDA) is one of the oldest and most popular linear methods for supervised classification problems. In this paper, we demonstrate that it is possible to compute the exact projection vector from LDA models based on unlabelled data, if some minimal prior information is available. More precisely, we show that only one of the following three pieces of information is actually sufficient to compute the LDA projection vector if only unlabelled data are available: (1) the class average of one of the two classes, (2) the difference between both class averages (up to a scaling), or (3) the class covariance matrices (up to a scaling). These theoretical results are validated in numerical experiments, demonstrating that this minimally informed Linear Discriminant Analysis (MILDA) model closely matches the performance of a supervised LDA model. Furthermore, we show that the MILDA projection vector can be computed in a closed form with a computational cost comparable to LDA and is able to quickly adapt to non-stationary data, making it well-suited to use as an adaptive classifier.
Resampling Stochastic Gradient Descent Cheaply for Efficient Uncertainty Quantification
Stochastic gradient descent (SGD) or stochastic approximation has been widely used in model training and stochastic optimization. While there is a huge literature on analyzing its convergence, inference on the obtained solutions from SGD has only been recently studied, yet is important due to the growing need for uncertainty quantification. We investigate two computationally cheap resampling-based methods to construct confidence intervals for SGD solutions. One uses multiple, but few, SGDs in parallel via resampling with replacement from the data, and another operates this in an online fashion. Our methods can be regarded as enhancements of established bootstrap schemes to substantially reduce the computation effort in terms of resampling requirements, while at the same time bypassing the intricate mixing conditions in existing batching methods. We achieve these via a recent so-called cheap bootstrap idea and Berry-Esseen-type bound for SGD.
WGoM: A novel model for categorical data with weighted responses
The Graded of Membership (GoM) model is a powerful tool for inferring latent classes in categorical data, which enables subjects to belong to multiple latent classes. However, its application is limited to categorical data with nonnegative integer responses, making it inappropriate for datasets with continuous or negative responses. To address this limitation, this paper proposes a novel model named the Weighted Grade of Membership (WGoM) model. Compared with GoM, our WGoM relaxes GoM's distribution constraint on the generation of a response matrix and it is more general than GoM. We then propose an algorithm to estimate the latent mixed memberships and the other WGoM parameters. We derive the error bounds of the estimated parameters and show that the algorithm is statistically consistent. The algorithmic performance is validated in both synthetic and real-world datasets. The results demonstrate that our algorithm is accurate and efficient, indicating its high potential for practical applications. This paper makes a valuable contribution to the literature by introducing a novel model that extends the applicability of the GoM model and provides a more flexible framework for analyzing categorical data with weighted responses.
Latent class analysis with weighted responses
The latent class model has been proposed as a powerful tool for cluster analysis of categorical data in various fields such as social, psychological, behavioral, and biological sciences. However, one important limitation of the latent class model is that it is only suitable for data with binary responses, making it fail to model real-world data with continuous or negative responses. In many applications, ignoring the weights throws out a lot of potentially valuable information contained in the weights. To address this limitation, we propose a novel generative model, the weighted latent class model (WLCM). Our model allows data's response matrix to be generated from an arbitrary distribution with a latent class structure. In comparison to the latent class model, our WLCM is more realistic and more general. To our knowledge, our WLCM is the first model for latent class analysis with weighted responses. We investigate the identifiability of the model and propose an efficient algorithm for estimating the latent classes and other model parameters. We show that the proposed algorithm enjoys consistent estimation. The performance of the proposed algorithm is investigated using both computer-generated and real-world weighted response data.
TacticAI: an AI assistant for football tactics
Wang, Zhe, Veličković, Petar, Hennes, Daniel, Tomašev, Nenad, Prince, Laurel, Kaisers, Michael, Bachrach, Yoram, Elie, Romuald, Wenliang, Li Kevin, Piccinini, Federico, Spearman, William, Graham, Ian, Connor, Jerome, Yang, Yi, Recasens, Adrià, Khan, Mina, Beauguerlange, Nathalie, Sprechmann, Pablo, Moreno, Pol, Heess, Nicolas, Bowling, Michael, Hassabis, Demis, Tuyls, Karl
Identifying key patterns of tactics implemented by rival teams, and developing effective responses, lies at the heart of modern football. However, doing so algorithmically remains an open research challenge. To address this unmet need, we propose TacticAI, an AI football tactics assistant developed and evaluated in close collaboration with domain experts from Liverpool FC. We focus on analysing corner kicks, as they offer coaches the most direct opportunities for interventions and improvements. TacticAI incorporates both a predictive and a generative component, allowing the coaches to effectively sample and explore alternative player setups for each corner kick routine and to select those with the highest predicted likelihood of success. We validate TacticAI on a number of relevant benchmark tasks: predicting receivers and shot attempts and recommending player position adjustments. The utility of TacticAI is validated by a qualitative study conducted with football domain experts at Liverpool FC. We show that TacticAI's model suggestions are not only indistinguishable from real tactics, but also favoured over existing tactics 90% of the time, and that TacticAI offers an effective corner kick retrieval system. TacticAI achieves these results despite the limited availability of gold-standard data, achieving data efficiency through geometric deep learning.
Mixed Variational Flows for Discrete Variables
Diluvi, Gian Carlo, Bloem-Reddy, Benjamin, Campbell, Trevor
Variational flows allow practitioners to learn complex continuous distributions, but approximating discrete distributions remains a challenge. Current methodologies typically embed the discrete target in a continuous space - usually via continuous relaxation or dequantization - and then apply a continuous flow. These approaches involve a surrogate target that may not capture the original discrete target, might have biased or unstable gradients, and can create a difficult optimization problem. In this work, we develop a variational flow family for discrete distributions without any continuous embedding. First, we develop a measure-preserving and discrete (MAD) invertible map that leaves the discrete target invariant, and then create a mixed variational flow (MAD Mix) based on that map. Our family provides access to i.i.d. sampling and density evaluation with virtually no tuning effort. We also develop an extension to MAD Mix that handles joint discrete and continuous models. Our experiments suggest that MAD Mix produces more reliable approximations than continuous-embedding flows while being significantly faster to train.
Generalized equivalences between subsampling and ridge regularization
We establish precise structural and risk equivalences between subsampling and ridge regularization for ensemble ridge estimators. Specifically, we prove that linear and quadratic functionals of subsample ridge estimators, when fitted with different ridge regularization levels $\lambda$ and subsample aspect ratios $\psi$, are asymptotically equivalent along specific paths in the $(\lambda,\psi)$-plane (where $\psi$ is the ratio of the feature dimension to the subsample size). Our results only require bounded moment assumptions on feature and response distributions and allow for arbitrary joint distributions. Furthermore, we provide a data-dependent method to determine the equivalent paths of $(\lambda,\psi)$. An indirect implication of our equivalences is that optimally tuned ridge regression exhibits a monotonic prediction risk in the data aspect ratio. This resolves a recent open problem raised by Nakkiran et al. for general data distributions under proportional asymptotics, assuming a mild regularity condition that maintains regression hardness through linearized signal-to-noise ratios.
Multivariate Probabilistic CRPS Learning with an Application to Day-Ahead Electricity Prices
Berrisch, Jonathan, Ziel, Florian
This paper presents a new method for combining (or aggregating or ensembling) multivariate probabilistic forecasts, considering dependencies between quantiles and marginals through a smoothing procedure that allows for online learning. We discuss two smoothing methods: dimensionality reduction using Basis matrices and penalized smoothing. The new online learning algorithm generalizes the standard CRPS learning framework into multivariate dimensions. It is based on Bernstein Online Aggregation (BOA) and yields optimal asymptotic learning properties. The procedure uses horizontal aggregation, i.e., aggregation across quantiles. We provide an in-depth discussion on possible extensions of the algorithm and several nested cases related to the existing literature on online forecast combination. We apply the proposed methodology to forecasting day-ahead electricity prices, which are 24-dimensional distributional forecasts. The proposed method yields significant improvements over uniform combination in terms of continuous ranked probability score (CRPS). We discuss the temporal evolution of the weights and hyperparameters and present the results of reduced versions of the preferred model. A fast C++ implementation of the proposed algorithm will be made available in connection with this paper as an open-source R-Package on CRAN.
How accurate are neural approximations of complex network dynamics?
Vasiliauskaite, Vaiva, Antulov-Fantulin, Nino
Data-driven approximations of ordinary differential equations offer a promising alternative to classical methods of discovering a dynamical system model, particularly in complex systems lacking explicit first principles. This paper focuses on a complex system whose dynamics is described with a system of such equations, coupled through a complex network. Numerous real-world systems, including financial, social, and neural systems, belong to this class of dynamical models. We propose essential elements for approximating these dynamical systems using neural networks, including necessary biases and an appropriate neural architecture. Emphasizing the differences from static supervised learning, we advocate for evaluating generalization beyond classical assumptions of statistical learning theory. To estimate confidence in prediction during inference time, we introduce a dedicated null model. By studying various complex network dynamics, we demonstrate that the neural approximations of dynamics generalize across complex network structures, sizes, and statistical properties of inputs. Our comprehensive framework enables accurate and reliable deep learning approximations of high-dimensional, nonlinear dynamical systems.