This thesis focuses on two topics, computational methods for large spatial datasets and functional data ranking. Both are tackling the challenges of big and high-dimensional data. The first topic is motivated by the prohibitive computational burden in fitting Gaussian process models to large and irregularly spaced spatial datasets. Various approximation methods have been introduced to reduce the computational cost, but many rely on unrealistic assumptions about the process and retaining statistical efficiency remains an issue. We propose a new scheme to approximate the maximum likelihood estimator and the kriging predictor when the exact computation is infeasible. The proposed method provides different types of hierarchical low-rank approximations that are both computationally and statistically efficient. We explore the improvement of the approximation theoretically and investigate the performance by simulations. For real applications, we analyze a soil moisture dataset with 2 million measurements with the hierarchical low-rank approximation and apply the proposed fast kriging to fill gaps for satellite images. The second topic is motivated by rank-based outlier detection methods for functional data. Compared to magnitude outliers, it is more challenging to detect shape outliers as they are often masked among samples. We develop a new notion of functional data depth by taking the integration of a univariate depth function. Having a form of the integrated depth, it shares many desirable features. Furthermore, the novel formation leads to a useful decomposition for detecting both shape and magnitude outliers. Our simulation studies show the proposed outlier detection procedure outperforms competitors in various outlier models. We also illustrate our methodology using real datasets of curves, images, and video frames. Finally, we introduce the functional data ranking technique to spatio-temporal statistics for visualizing and assessing covariance properties, such as separability and full symmetry. We formulate test functions as functions of temporal lags for each pair of spatial locations and develop a rank-based testing procedure induced by functional data depth for assessing these properties. The method is illustrated using simulated data from widely used spatio-temporal covariance models, as well as real datasets from weather stations and climate model outputs.

Malgré des progrès constants en termes de capacité de calcul, mémoire et quantité de données disponibles, les algorithmes d'apprentissage machine doivent se montrer efficaces dans l'utilisation de ces ressources. La minimisation des coûts est évidemment un facteur important, mais une autre motivation est la recherche de mécanismes d'apprentissage capables de reproduire le comportement d'êtres intelligents. Cette thèse aborde le problème de l'efficacité à travers plusieurs articles traitant d'algorithmes d'apprentissage variés : ce problème est vu non seulement du point de vue de l'efficacité computationnelle (temps de calcul et mémoire utilisés), mais aussi de celui de l'efficacité statistique (nombre d'exemples requis pour accomplir une tâche donnée). Une première contribution apportée par cette thèse est la mise en lumière d'inefficacités statistiques dans des algorithmes existants. Nous montrons ainsi que les arbres de décision généralisent mal pour certains types de tâches (chapitre 3), de même que les algorithmes classiques d'apprentissage semi-supervisé à base de graphe (chapitre 5), chacun étant affecté par une forme particulière de la malédiction de la dimensionalité. Pour une certaine classe de réseaux de neurones, appelés réseaux sommes-produits, nous montrons qu'il peut être exponentiellement moins efficace de représenter certaines fonctions par des réseaux à une seule couche cachée, comparé à des réseaux profonds (chapitre 4). Nos analyses permettent de mieux comprendre certains problèmes intrinsèques liés à ces algorithmes, et d'orienter la recherche dans des directions qui pourraient permettre de les résoudre. Nous identifions également des inefficacités computationnelles dans les algorithmes d'apprentissage semi-supervisé à base de graphe (chapitre 5), et dans l'apprentissage de mélanges de Gaussiennes en présence de valeurs manquantes (chapitre 6). Dans les deux cas, nous proposons de nouveaux algorithmes capables de traiter des ensembles de données significativement plus grands. Les deux derniers chapitres traitent de l'efficacité computationnelle sous un angle différent. Dans le chapitre 7, nous analysons de manière théorique un algorithme existant pour l'apprentissage efficace dans les machines de Boltzmann restreintes (la divergence contrastive), afin de mieux comprendre les raisons qui expliquent le succès de cet algorithme. Finalement, dans le chapitre 8 nous présentons une application de l'apprentissage machine dans le domaine des jeux vidéo, pour laquelle le problème de l'efficacité computationnelle est relié à des considérations d'ingénierie logicielle et matérielle, souvent ignorées en recherche mais ô combien importantes en pratique. / Despite constant progress in terms of available computational power, memory and amount of data, machine learning algorithms need to be efficient in how they use them. Although minimizing cost is an obvious major concern, another motivation is to attempt to design algorithms that can learn as efficiently as intelligent species. This thesis tackles the problem of efficient learning through various papers dealing with a wide range of machine learning algorithms: this topic is seen both from the point of view of computational efficiency (processing power and memory required by the algorithms) and of statistical efficiency (n umber of samples necessary to solve a given learning task).The first contribution of this thesis is in shedding light on various statistical inefficiencies in existing algorithms. Indeed, we show that decision trees do not generalize well on tasks with some particular properties (chapter 3), and that a similar flaw affects typical graph-based semi-supervised learning algorithms (chapter 5). This flaw is a form of curse of dimensionality that is specific to each of these algorithms. For a subclass of neural networks, called sum-product networks, we prove that using networks with a single hidden layer can be exponentially less efficient than when using deep networks (chapter 4). Our analyses help better understand some inherent flaws found in these algorithms, and steer research towards approaches that may potentially overcome them. We also exhibit computational inefficiencies in popular graph-based semi-supervised learning algorithms (chapter 5) as well as in the learning of mixtures of Gaussians with missing data (chapter 6). In both cases we propose new algorithms that make it possible to scale to much larger datasets. The last two chapters also deal with computational efficiency, but in different ways. Chapter 7 presents a new view on the contrastive divergence algorithm (which has been used for efficient training of restricted Boltzmann machines). It provides additional insight on the reasons why this algorithm has been so successful. Finally, in chapter 8 we describe an application of machine learning to video games, where computational efficiency is tied to software and hardware engineering constraints which, although often ignored in research papers, are ubiquitous in practice.

The research in the field of travel demand modeling is driven by the need to understand individuals’ behavior in the context of travel-related decisions as accurately as possible. In this regard, the activity-based approach to modeling travel demand has received substantial attention in the past decade, both in the research arena as well as in practice. At the same time, recent efforts have been focused on more fully realizing the potential of activity-based models by explicitly recognizing the multi-dimensional nature of activity-travel decisions. However, as more behavioral elements/dimensions are added, the dimensionality of the model systems tends to explode, making the estimation of such models all but infeasible using traditional inference methods. As a result, analysts and practitioners often trade-off between recognizing attributes that will make a model behaviorally more representative (from a theoretical viewpoint) and being able to estimate/implement a model (from a practical viewpoint). An alternative approach to deal with the estimation complications arising from multi-dimensional choice situations is the technique of composite marginal likelihood (CML). This is an estimation technique that is gaining substantial attention in the statistics field, though there has been relatively little coverage of this method in transportation and other fields. The CML approach is a conceptually and pedagogically simpler simulation-free procedure (relative to traditional approaches that employ simulation techniques), and has the advantage of reproducibility of the results. Under the usual regularity assumptions, the CML estimator is consistent, unbiased, and asymptotically normally distributed. The discussion above indicates that the CML approach has the potential to contribute in the area of travel demand modeling in a significant way. For example, the approach can be used to develop conceptually and behaviorally more appealing models to examine individuals’ travel decisions in a joint framework. The overarching goal of the current research work is to demonstrate the applicability of the CML approach in the area of activity-travel demand modeling and to highlight the enhanced features of the choice models estimated using the CML approach. The goal of the dissertation is achieved in three steps as follows: (1) by evaluating the performance of the CML approach in multivariate situations, (2) by developing multidimensional choice models using the CML approach, and (3) by demonstrating applications of the multidimensional choice models developed in the current dissertation. / text

Malgré des progrès constants en termes de capacité de calcul, mémoire et quantité de données disponibles, les algorithmes d'apprentissage machine doivent se montrer efficaces dans l'utilisation de ces ressources. La minimisation des coûts est évidemment un facteur important, mais une autre motivation est la recherche de mécanismes d'apprentissage capables de reproduire le comportement d'êtres intelligents. Cette thèse aborde le problème de l'efficacité à travers plusieurs articles traitant d'algorithmes d'apprentissage variés : ce problème est vu non seulement du point de vue de l'efficacité computationnelle (temps de calcul et mémoire utilisés), mais aussi de celui de l'efficacité statistique (nombre d'exemples requis pour accomplir une tâche donnée). Une première contribution apportée par cette thèse est la mise en lumière d'inefficacités statistiques dans des algorithmes existants. Nous montrons ainsi que les arbres de décision généralisent mal pour certains types de tâches (chapitre 3), de même que les algorithmes classiques d'apprentissage semi-supervisé à base de graphe (chapitre 5), chacun étant affecté par une forme particulière de la malédiction de la dimensionalité. Pour une certaine classe de réseaux de neurones, appelés réseaux sommes-produits, nous montrons qu'il peut être exponentiellement moins efficace de représenter certaines fonctions par des réseaux à une seule couche cachée, comparé à des réseaux profonds (chapitre 4). Nos analyses permettent de mieux comprendre certains problèmes intrinsèques liés à ces algorithmes, et d'orienter la recherche dans des directions qui pourraient permettre de les résoudre. Nous identifions également des inefficacités computationnelles dans les algorithmes d'apprentissage semi-supervisé à base de graphe (chapitre 5), et dans l'apprentissage de mélanges de Gaussiennes en présence de valeurs manquantes (chapitre 6). Dans les deux cas, nous proposons de nouveaux algorithmes capables de traiter des ensembles de données significativement plus grands. Les deux derniers chapitres traitent de l'efficacité computationnelle sous un angle différent. Dans le chapitre 7, nous analysons de manière théorique un algorithme existant pour l'apprentissage efficace dans les machines de Boltzmann restreintes (la divergence contrastive), afin de mieux comprendre les raisons qui expliquent le succès de cet algorithme. Finalement, dans le chapitre 8 nous présentons une application de l'apprentissage machine dans le domaine des jeux vidéo, pour laquelle le problème de l'efficacité computationnelle est relié à des considérations d'ingénierie logicielle et matérielle, souvent ignorées en recherche mais ô combien importantes en pratique. / Despite constant progress in terms of available computational power, memory and amount of data, machine learning algorithms need to be efficient in how they use them. Although minimizing cost is an obvious major concern, another motivation is to attempt to design algorithms that can learn as efficiently as intelligent species. This thesis tackles the problem of efficient learning through various papers dealing with a wide range of machine learning algorithms: this topic is seen both from the point of view of computational efficiency (processing power and memory required by the algorithms) and of statistical efficiency (n umber of samples necessary to solve a given learning task).The first contribution of this thesis is in shedding light on various statistical inefficiencies in existing algorithms. Indeed, we show that decision trees do not generalize well on tasks with some particular properties (chapter 3), and that a similar flaw affects typical graph-based semi-supervised learning algorithms (chapter 5). This flaw is a form of curse of dimensionality that is specific to each of these algorithms. For a subclass of neural networks, called sum-product networks, we prove that using networks with a single hidden layer can be exponentially less efficient than when using deep networks (chapter 4). Our analyses help better understand some inherent flaws found in these algorithms, and steer research towards approaches that may potentially overcome them. We also exhibit computational inefficiencies in popular graph-based semi-supervised learning algorithms (chapter 5) as well as in the learning of mixtures of Gaussians with missing data (chapter 6). In both cases we propose new algorithms that make it possible to scale to much larger datasets. The last two chapters also deal with computational efficiency, but in different ways. Chapter 7 presents a new view on the contrastive divergence algorithm (which has been used for efficient training of restricted Boltzmann machines). It provides additional insight on the reasons why this algorithm has been so successful. Finally, in chapter 8 we describe an application of machine learning to video games, where computational efficiency is tied to software and hardware engineering constraints which, although often ignored in research papers, are ubiquitous in practice.