Efficient Regularized Least-Squares Algorithms for Conditional Ranking on Relational Data

In domains like bioinformatics, information retrieval and social network analysis, one can find learning tasks where the goal consists of inferring a ranking of objects, conditioned on a particular target object. We present a general kernel framework for learning conditional rankings from various types of relational data, where rankings can be conditioned on unseen data objects. We propose efficient algorithms for conditional ranking by optimizing squared regression and ranking loss functions. We show theoretically, that learning with the ranking loss is likely to generalize better than with the regression loss. Further, we prove that symmetry or reciprocity properties of relations can be efficiently enforced in the learned models. Experiments on synthetic and real-world data illustrate that the proposed methods deliver state-of-the-art performance in terms of predictive power and computational efficiency. Moreover, we also show empirically that incorporating symmetry or reciprocity properties can improve the generalization performance

Exact and efficient top-K inference for multi-target prediction by querying separable linear relational models

Many complex multi-target prediction problems that concern large target spaces are characterised by a need for efficient prediction strategies that avoid the computation of predictions for all targets explicitly. Examples of such problems emerge in several subfields of machine learning, such as collaborative filtering, multi-label classification, dyadic prediction and biological network inference. In this article we analyse efficient and exact algorithms for computing the top-$K$ predictions in the above problem settings, using a general class of models that we refer to as separable linear relational models. We show how to use those inference algorithms, which are modifications of well-known information retrieval methods, in a variety of machine learning settings. Furthermore, we study the possibility of scoring items incompletely, while still retaining an exact top-K retrieval. Experimental results in several application domains reveal that the so-called threshold algorithm is very scalable, performing often many orders of magnitude more efficiently than the naive approach

Transposable regularized covariance models with an application to missing data imputation

Missing data estimation is an important challenge with high-dimensional data arranged in the form of a matrix. Typically this data matrix is transposable, meaning that either the rows, columns or both can be treated as features. To model transposable data, we present a modification of the matrix-variate normal, the mean-restricted matrix-variate normal, in which the rows and columns each have a separate mean vector and covariance matrix. By placing additive penalties on the inverse covariance matrices of the rows and columns, these so-called transposable regularized covariance models allow for maximum likelihood estimation of the mean and nonsingular covariance matrices. Using these models, we formulate EM-type algorithms for missing data imputation in both the multivariate and transposable frameworks. We present theoretical results exploiting the structure of our transposable models that allow these models and imputation methods to be applied to high-dimensional data. Simulations and results on microarray data and the Netflix data show that these imputation techniques often outperform existing methods and offer a greater degree of flexibility.Comment: Published in at http://dx.doi.org/10.1214/09-AOAS314 the Annals of Applied Statistics (http://www.imstat.org/aoas/) by the Institute of Mathematical Statistics (http://www.imstat.org

A two-step learning approach for solving full and almost full cold start problems in dyadic prediction

Dyadic prediction methods operate on pairs of objects (dyads), aiming to infer labels for out-of-sample dyads. We consider the full and almost full cold start problem in dyadic prediction, a setting that occurs when both objects in an out-of-sample dyad have not been observed during training, or if one of them has been observed, but very few times. A popular approach for addressing this problem is to train a model that makes predictions based on a pairwise feature representation of the dyads, or, in case of kernel methods, based on a tensor product pairwise kernel. As an alternative to such a kernel approach, we introduce a novel two-step learning algorithm that borrows ideas from the fields of pairwise learning and spectral filtering. We show theoretically that the two-step method is very closely related to the tensor product kernel approach, and experimentally that it yields a slightly better predictive performance. Moreover, unlike existing tensor product kernel methods, the two-step method allows closed-form solutions for training and parameter selection via cross-validation estimates both in the full and almost full cold start settings, making the approach much more efficient and straightforward to implement

Integrating prior knowledge into factorization approaches for relational learning

An efficient way to represent the domain knowledge is relational data, where information is recorded in form of relationships between entities. Relational data is becoming ubiquitous over the years for knowledge representation due to the fact that many real-word data is inherently interlinked. Some well-known examples of relational data are: the World Wide Web (WWW), a system of interlinked hypertext documents; the Linked Open Data (LOD) cloud of the Semantic Web, a collection of published data and their interlinks; and finally the Internet of Things (IoT), a network of physical objects with internal states and communications ability. Relational data has been addressed by many different machine learning approaches, the most promising ones are in the area of relational learning, which is the focus of this thesis. While conventional machine learning algorithms consider entities as being independent instances randomly sampled from some statistical distribution and being represented as data points in a vector space, relational learning takes into account the overall network environment when predicting the label of an entity, an attribute value of an entity or the existence of a relationship between entities. An important feature is that relational learning can exploit contextual information that is more distant in the relational network. As the volume and structural complexity of the relational data increase constantly in the era of Big Data, scalability and the modeling power become crucial for relational learning algorithms. Previous relational learning algorithms either provide an intuitive representation of the model, such as Inductive Logic Programming (ILP) and Markov Logic Networks (MLNs), or assume a set of latent variables to explain the observed data, such as the Infinite Hidden Relational Model (IHRM), the Infinite Relational Model (IRM) and factorization approaches. Models with intuitive representations often involve some form of structure learning which leads to scalability problems due to a typically large search space. Factorizations are among the best-performing approaches for large-scale relational learning since the algebraic computations can easily be parallelized and since they can exploit data sparsity. Previous factorization approaches exploit only patterns in the relational data itself and the focus of the thesis is to investigate how additional prior information (comprehensive information), either in form of unstructured data (e.g., texts) or structured patterns (e.g., in form of rules) can be considered in the factorization approaches. The goal is to enhance the predictive power of factorization approaches by involving prior knowledge for the learning, and on the other hand to reduce the model complexity for efficient learning. This thesis contains two main contributions: The first contribution presents a general and novel framework for predicting relationships in multirelational data using a set of matrices describing the various instantiated relations in the network. The instantiated relations, derived or learnt from prior knowledge, are integrated as entities' attributes or entity-pairs' attributes into different adjacency matrices for the learning. All the information available is then combined in an additive way. Efficient learning is achieved using an alternating least squares approach exploiting sparse matrix algebra and low-rank approximation. As an illustration, several algorithms are proposed to include information extraction, deductive reasoning and contextual information in matrix factorizations for the Semantic Web scenario and for recommendation systems. Experiments on various data sets are conducted for each proposed algorithm to show the improvement in predictive power by combining matrix factorizations with prior knowledge in a modular way. In contrast to a matrix, a 3-way tensor si a more natural representation for the multirelational data where entities are connected by different types of relations. A 3-way tensor is a three dimensional array which represents the multirelational data by using the first two dimensions for entities and using the third dimension for different types of relations. In the thesis, an analysis on the computational complexity of tensor models shows that the decomposition rank is key for the success of an efficient tensor decomposition algorithm, and that the factorization rank can be reduced by including observable patterns. Based on these theoretical considerations, a second contribution of this thesis develops a novel tensor decomposition approach - an Additive Relational Effects (ARE) model - which combines the strengths of factorization approaches and prior knowledge in an additive way to discover different relational effects from the relational data. As a result, ARE consists of a decomposition part which derives the strong relational leaning effects from a highly scalable tensor decomposition approach RESCAL and a Tucker 1 tensor which integrates the prior knowledge as instantiated relations. An efficient least squares approach is proposed to compute the combined model ARE. The additive model contains weights that reflect the degree of reliability of the prior knowledge, as evaluated by the data. Experiments on several benchmark data sets show that the inclusion of prior knowledge can lead to better performing models at a low tensor rank, with significant benefits for run-time and storage requirements. In particular, the results show that ARE outperforms state-of-the-art relational learning algorithms including intuitive models such as MRC, which is an approach based on Markov Logic with structure learning, factorization approaches such as Tucker, CP, Bayesian Clustered Tensor Factorization (BCTF), the Latent Factor Model (LFM), RESCAL, and other latent models such as the IRM. A final experiment on a Cora data set for paper topic classification shows the improvement of ARE over RESCAL in both predictive power and runtime performance, since ARE requires a significantly lower rank

A kernel-based framework for learning graded relations from data

Driven by a large number of potential applications in areas like bioinformatics, information retrieval and social network analysis, the problem setting of inferring relations between pairs of data objects has recently been investigated quite intensively in the machine learning community. To this end, current approaches typically consider datasets containing crisp relations, so that standard classification methods can be adopted. However, relations between objects like similarities and preferences are often expressed in a graded manner in real-world applications. A general kernel-based framework for learning relations from data is introduced here. It extends existing approaches because both crisp and graded relations are considered, and it unifies existing approaches because different types of graded relations can be modeled, including symmetric and reciprocal relations. This framework establishes important links between recent developments in fuzzy set theory and machine learning. Its usefulness is demonstrated through various experiments on synthetic and real-world data.Comment: This work has been submitted to the IEEE for possible publication. Copyright may be transferred without notice, after which this version may no longer be accessibl

Kernel-Based Ranking. Methods for Learning and Performance Estimation

Machine learning provides tools for automated construction of predictive models in data intensive areas of engineering and science. The family of regularized kernel methods have in the recent years become one of the mainstream approaches to machine learning, due to a number of advantages the methods share. The approach provides theoretically well-founded solutions to the problems of under- and overfitting, allows learning from structured data, and has been empirically demonstrated to yield high predictive performance on a wide range of application domains. Historically, the problems of classification and regression have gained the majority of attention in the field. In this thesis we focus on another type of learning problem, that of learning to rank. In learning to rank, the aim is from a set of past observations to learn a ranking function that can order new objects according to how well they match some underlying criterion of goodness. As an important special case of the setting, we can recover the bipartite ranking problem, corresponding to maximizing the area under the ROC curve (AUC) in binary classification. Ranking applications appear in a large variety of settings, examples encountered in this thesis include document retrieval in web search, recommender systems, information extraction and automated parsing of natural language. We consider the pairwise approach to learning to rank, where ranking models are learned by minimizing the expected probability of ranking any two randomly drawn test examples incorrectly. The development of computationally efficient kernel methods, based on this approach, has in the past proven to be challenging. Moreover, it is not clear what techniques for estimating the predictive performance of learned models are the most reliable in the ranking setting, and how the techniques can be implemented efficiently. The contributions of this thesis are as follows. First, we develop RankRLS, a computationally efficient kernel method for learning to rank, that is based on minimizing a regularized pairwise least-squares loss. In addition to training methods, we introduce a variety of algorithms for tasks such as model selection, multi-output learning, and cross-validation, based on computational shortcuts from matrix algebra. Second, we improve the fastest known training method for the linear version of the RankSVM algorithm, which is one of the most well established methods for learning to rank. Third, we study the combination of the empirical kernel map and reduced set approximation, which allows the large-scale training of kernel machines using linear solvers, and propose computationally efficient solutions to cross-validation when using the approach. Next, we explore the problem of reliable cross-validation when using AUC as a performance criterion, through an extensive simulation study. We demonstrate that the proposed leave-pair-out cross-validation approach leads to more reliable performance estimation than commonly used alternative approaches. Finally, we present a case study on applying machine learning to information extraction from biomedical literature, which combines several of the approaches considered in the thesis. The thesis is divided into two parts. Part I provides the background for the research work and summarizes the most central results, Part II consists of the five original research articles that are the main contribution of this thesis.Siirretty Doriast