arXiv subjects

Jakob Raymaekers

Publications and source records attributed to Jakob Raymaekers.

33 records · Page 2Linked to original sources

arXiv2021

Class maps for visualizing classification results

Classification is a major tool of statistics and machine learning. A classification method first processes a training set of objects with given classes (labels), with the goal of afterward assigning new objects to one of these classes. When running the resulting prediction method on the training data or on test data, it can happen that an object is predicted to lie in a class that differs from its given label. This is sometimes called label bias, and raises the question whether the object was mislabeled. The proposed class map reflects the probability that an object belongs to an alternative class, how far it is from the other objects in its given class, and whether some objects lie far from all classes. The goal is to visualize aspects of the classification results to obtain insight in the data. The display is constructed for discriminant analysis, the k-nearest neighbor classifier, support vector machines, logistic regression, and coupling pairwise classifications. It is illustrated on several benchmark datasets, including some about images and texts.

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arXiv2020

Handling cellwise outliers by sparse regression and robust covariance

We propose a data-analytic method for detecting cellwise outliers. Given a robust covariance matrix, outlying cells (entries) in a row are found by the cellHandler technique which combines lasso regression with a stepwise application of constructed cutoff values. The penalty term of the lasso has a physical interpretation as the total distance that suspicious cells need to move in order to bring their row into the fold. For estimating a cellwise robust covariance matrix we construct a detection-imputation method which alternates between flagging outlying cells and updating the covariance matrix as in the EM algorithm. The proposed methods are illustrated by simulations and on real data about volatile organic compounds in children.

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arXiv2020

Transforming variables to central normality

Many real data sets contain numerical features (variables) whose distribution is far from normal (gaussian). Instead, their distribution is often skewed. In order to handle such data it is customary to preprocess the variables to make them more normal. The Box-Cox and Yeo-Johnson transformations are well-known tools for this. However, the standard maximum likelihood estimator of their transformation parameter is highly sensitive to outliers, and will often try to move outliers inward at the expense of the normality of the central part of the data. We propose a modification of these transformations as well as an estimator of the transformation parameter that is robust to outliers, so the transformed data can be approximately normal in the center and a few outliers may deviate from it. It compares favorably to existing techniques in an extensive simulation study and on real data.

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arXiv2020

Real-time discriminant analysis in the presence of label and measurement noise

Quadratic discriminant analysis (QDA) is a widely used classification technique. Based on a training dataset, each class in the data is characterized by an estimate of its center and shape, which can then be used to assign unseen observations to one of the classes. The traditional QDA rule relies on the empirical mean and covariance matrix. Unfortunately, these estimators are sensitive to label and measurement noise which often impairs the model's predictive ability. Robust estimators of location and scatter are resistant to this type of contamination. However, they have a prohibitive computational cost for large scale industrial experiments. We present a novel QDA method based on a recent real-time robust algorithm. We additionally integrate an anomaly detection step to classify the most atypical observations into a separate class of outliers. Finally, we introduce the label bias plot, a graphical display to identify label and measurement noise in the training data. The performance of the proposed approach is illustrated in a simulation study with huge datasets, and on real datasets about diabetes and fruit.

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arXiv2020

Regularized K-means through hard-thresholding

We study a framework of regularized $K$-means methods based on direct penalization of the size of the cluster centers. Different penalization strategies are considered and compared through simulation and theoretical analysis. Based on the results, we propose HT $K$-means, which uses an $\ell_0$ penalty to induce sparsity in the variables. Different techniques for selecting the tuning parameter are discussed and compared. The proposed method stacks up favorably with the most popular regularized $K$-means methods in an extensive simulation study. Finally, HT $K$-means is applied to several real data examples. Graphical displays are presented and used in these examples to gain more insight into the datasets.

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arXiv2020

Pooled variable scaling for cluster analysis

We propose a new approach for scaling prior to cluster analysis based on the concept of pooled variance. Unlike available scaling procedures such as the standard deviation and the range, our proposed scale avoids dampening the beneficial effect of informative clustering variables. We confirm through an extensive simulation study and applications to well known real data examples that the proposed scaling method is safe and generally useful. Finally, we use our approach to cluster a high dimensional genomic dataset consisting of gene expression data for several specimens of breast cancer cells tissue.

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arXiv2020

Real-time outlier detection for large datasets by RT-DetMCD

Modern industrial machines can generate gigabytes of data in seconds, frequently pushing the boundaries of available computing power. Together with the time criticality of industrial processing this presents a challenging problem for any data analytics procedure. We focus on the deterministic minimum covariance determinant method (DetMCD), which detects outliers by fitting a robust covariance matrix. We construct a much faster version of DetMCD by replacing its initial estimators by two new methods and incorporating update-based concentration steps. The computation time is reduced further by parallel computing, with a novel robust aggregation method to combine the results from the threads. The speed and accuracy of the proposed real-time DetMCD method (RT-DetMCD) are illustrated by simulation and a real industrial application to food sorting.

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arXiv2019

Fast robust correlation for high-dimensional data

The product moment covariance is a cornerstone of multivariate data analysis, from which one can derive correlations, principal components, Mahalanobis distances and many other results. Unfortunately the product moment covariance and the corresponding Pearson correlation are very susceptible to outliers (anomalies) in the data. Several robust measures of covariance have been developed, but few are suitable for the ultrahigh dimensional data that are becoming more prevalent nowadays. For that one needs methods whose computation scales well with the dimension, are guaranteed to yield a positive semidefinite covariance matrix, and are sufficiently robust to outliers as well as sufficiently accurate in the statistical sense of low variability. We construct such methods using data transformations. The resulting approach is simple, fast and widely applicable. We study its robustness by deriving influence functions and breakdown values, and computing the mean squared error on contaminated data. Using these results we select a method that performs well overall. This also allows us to construct a faster version of the DetectDeviatingCells method (Rousseeuw and Van den Bossche, 2018) to detect cellwise outliers, that can deal with much higher dimensions. The approach is illustrated on genomic data with 12,000 variables and color video data with 920,000 dimensions.

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arXiv2018

A generalized spatial sign covariance matrix

The well-known spatial sign covariance matrix (SSCM) carries out a radial transform which moves all data points to a sphere, followed by computing the classical covariance matrix of the transformed data. Its popularity stems from its robustness to outliers, fast computation, and applications to correlation and principal component analysis. In this paper we study more general radial functions. It is shown that the eigenvectors of the generalized SSCM are still consistent and the ranks of the eigenvalues are preserved. The influence function of the resulting scatter matrix is derived, and it is shown that its breakdown value is as high as that of the original SSCM. A simulation study indicates that the best results are obtained when the inner half of the data points are not transformed and points lying far away are moved to the center.

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arXiv2018

Clustering genomic words in human DNA using peaks and trends of distributions

In this work we seek clusters of genomic words in human DNA by studying their inter-word lag distributions. Due to the particularly spiked nature of these histograms, a clustering procedure is proposed that first decomposes each distribution into a baseline and a peak distribution. An outlier-robust fitting method is used to estimate the baseline distribution (the `trend'), and a sparse vector of detrended data captures the peak structure. A simulation study demonstrates the effectiveness of the clustering procedure in grouping distributions with similar peak behavior and/or baseline features. The procedure is applied to investigate similarities between the distribution patterns of genomic words of lengths 3 and 5 in the human genome. These experiments demonstrate the potential of the new method for identifying words with similar distance patterns.

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arXiv2018

Discussion of "The power of monitoring"

This is an invited comment on the discussion paper "The power of monitoring: how to make the most of a contaminated multivariate sample" by A. Cerioli, M. Riani, A. Atkinson and A. Corbellini that will appear in the journal Statistical Methods & Applications.

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arXiv2017

Comparing reverse complementary genomic words based on their distance distributions and frequencies

In this work we study reverse complementary genomic word pairs in the human DNA, by comparing both the distance distribution and the frequency of a word to those of its reverse complement. Several measures of dissimilarity between distance distributions are considered, and it is found that the peak dissimilarity works best in this setting. We report the existence of reverse complementary word pairs with very dissimilar distance distributions, as well as word pairs with very similar distance distributions even when both distributions are irregular and contain strong peaks. The association between distribution dissimilarity and frequency discrepancy is explored also, and it is speculated that symmetric pairs combining low and high values of each measure may uncover features of interest. Taken together, our results suggest that some asymmetries in the human genome go far beyond Chargaff's rules. This study uses both the complete human genome and its repeat-masked version.

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arXiv2017

Dissimilar Symmetric Word Pairs in the Human Genome

In this work we explore the dissimilarity between symmetric word pairs, by comparing the inter-word distance distribution of a word to that of its reversed complement. We propose a new measure of dissimilarity between such distributions. Since symmetric pairs with different patterns could point to evolutionary features, we search for the pairs with the most dissimilar behaviour. We focus our study on the complete human genome and its repeat-masked version.

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arXiv2017

A Measure of Directional Outlyingness with Applications to Image Data and Video

Functional data covers a wide range of data types. They all have in common that the observed objects are functions of of a univariate argument (e.g. time or wavelength) or a multivariate argument (say, a spatial position). These functions take on values which can in turn be univariate (such as the absorbance level) or multivariate (such as the red/green/blue color levels of an image). In practice it is important to be able to detect outliers in such data. For this purpose we introduce a new measure of outlyingness that we compute at each gridpoint of the functions' domain. The proposed Directional Outlyingness} (DO) measure accounts for skewness in the data and only requires O(n) computation time per direction. We derive the influence function of the DO and compute a cutoff for outlier detection. The resulting heatmap and functional outlier map reflect local and global outlyingness of a function. To illustrate the performance of the method on real data it is applied to spectra, MRI images, and video surveillance data.

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arXiv2016

Finding Outliers in Surface Data and Video

Surface, image and video data can be considered as functional data with a bivariate domain. To detect outlying surfaces or images, a new method is proposed based on the mean and the variability of the degree of outlyingness at each grid point. A rule is constructed to flag the outliers in the resulting functional outlier map. Heatmaps of their outlyingness indicate the regions which are most deviating from the regular surfaces. The method is applied to fluorescence excitation-emission spectra after fitting a PARAFAC model, to MRI image data which are augmented with their gradients, and to video surveillance data.

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