Rafael B. Stern

Gustavo Grivol, Rafael Izbicki, Alex A. Okuno et al.

This paper introduces FlexCodeTS, a new conditional density estimator for time series. FlexCodeTS is a flexible nonparametric conditional density estimator, which can be based on an arbitrary regression method. It is shown that FlexCodeTS inherits the rate of convergence of the chosen regression method. Hence, FlexCodeTS can adapt its convergence by employing the regression method that best fits the structure of data. From an empirical perspective, FlexCodeTS is compared to NNKCDE and GARCH in both simulated and real data. FlexCodeTS is shown to generally obtain the best performance among the selected methods according to either the CDE loss or the pinball loss.

Luben M. C. Cabezas, Mateus P. Otto, Rafael Izbicki et al.

Predictive models make mistakes. Hence, there is a need to quantify the uncertainty associated with their predictions. Conformal inference has emerged as a powerful tool to create statistically valid prediction regions around point predictions, but its naive application to regression problems yields non-adaptive regions. New conformal scores, often relying upon quantile regressors or conditional density estimators, aim to address this limitation. Although they are useful for creating prediction bands, these scores are detached from the original goal of quantifying the uncertainty around an arbitrary predictive model. This paper presents a new, model-agnostic family of methods to calibrate prediction intervals for regression problems with local coverage guarantees. Our approach is based on pursuing the coarsest partition of the feature space that approximates conditional coverage. We create this partition by training regression trees and Random Forests on conformity scores. Our proposal is versatile, as it applies to various conformity scores and prediction settings and demonstrates superior scalability and performance compared to established baselines in simulated and real-world datasets. We provide a Python package clover that implements our methods using the standard scikit-learn interface.

Luben M. C. Cabezas, Rafael Izbicki, Rafael B. Stern

We propose methods for the analysis of hierarchical clustering that fully use the multi-resolution structure provided by a dendrogram. Specifically, we propose a loss for choosing between clustering methods, a feature importance score and a graphical tool for visualizing the segmentation of features in a dendrogram. Current approaches to these tasks lead to loss of information since they require the user to generate a single partition of the instances by cutting the dendrogram at a specified level. Our proposed methods, instead, use the full structure of the dendrogram. The key insight behind the proposed methods is to view a dendrogram as a phylogeny. This analogy permits the assignment of a feature value to each internal node of a tree through an evolutionary model. Real and simulated datasets provide evidence that our proposed framework has desirable outcomes and gives more insights than state-of-art approaches. We provide an R package that implements our methods.

Rafael Izbicki, Gilson Shimizu, Rafael B. Stern

Conformal methods create prediction bands that control average coverage assuming solely i.i.d. data. Although the literature has mostly focused on prediction intervals, more general regions can often better represent uncertainty. For instance, a bimodal target is better represented by the union of two intervals. Such prediction regions are obtained by CD-split , which combines the split method and a data-driven partition of the feature space which scales to high dimensions. CD-split however contains many tuning parameters, and their role is not clear. In this paper, we provide new insights on CD-split by exploring its theoretical properties. In particular, we show that CD-split converges asymptotically to the oracle highest predictive density set and satisfies local and asymptotic conditional validity. We also present simulations that show how to tune CD-split. Finally, we introduce HPD-split, a variation of CD-split that requires less tuning, and show that it shares the same theoretical guarantees as CD-split. In a wide variety of our simulations, CD-split and HPD-split have better conditional coverage and yield smaller prediction regions than other methods.

Rafael Izbicki, Gilson T. Shimizu, Rafael B. Stern

Conformal methods create prediction bands that control average coverage under no assumptions besides i.i.d. data. Besides average coverage, one might also desire to control conditional coverage, that is, coverage for every new testing point. However, without strong assumptions, conditional coverage is unachievable. Given this limitation, the literature has focused on methods with asymptotical conditional coverage. In order to obtain this property, these methods require strong conditions on the dependence between the target variable and the features. We introduce two conformal methods based on conditional density estimators that do not depend on this type of assumption to obtain asymptotic conditional coverage: Dist-split and CD-split. While Dist-split asymptotically obtains optimal intervals, which are easier to interpret than general regions, CD-split obtains optimal size regions, which are smaller than intervals. CD-split also obtains local coverage by creating a data-driven partition of the feature space that scales to high-dimensional settings and by generating prediction bands locally on the partition elements. In a wide variety of simulated scenarios, our methods have a better control of conditional coverage and have smaller length than previously proposed methods.

Marco Henrique de Almeida Inácio, Rafael Izbicki, Rafael Bassi Stern

Conditional independence testing is a key problem required by many machine learning and statistics tools. In particular, it is one way of evaluating the usefulness of some features on a supervised prediction problem. We propose a novel conditional independence test in a predictive setting, and show that it achieves better power than competing approaches in several settings. Our approach consists in deriving a p-value using a permutation test where the predictive power using the unpermuted dataset is compared with the predictive power of using dataset where the feature(s) of interest are permuted. We conclude that the method achives sensible results on simulated and real datasets.

Afonso Fernandes Vaz, Rafael Izbicki, Rafael Bassi Stern

The quantification problem consists of determining the prevalence of a given label in a target population. However, one often has access to the labels in a sample from the training population but not in the target population. A common assumption in this situation is that of prior probability shift, that is, once the labels are known, the distribution of the features is the same in the training and target populations. In this paper, we derive a new lower bound for the risk of the quantification problem under the prior shift assumption. Complementing this lower bound, we present a new approximately minimax class of estimators, ratio estimators, which generalize several previous proposals in the literature. Using a weaker version of the prior shift assumption, which can be tested, we show that ratio estimators can be used to build confidence intervals for the quantification problem. We also extend the ratio estimator so that it can: (i) incorporate labels from the target population, when they are available and (ii) estimate how the prevalence of positive labels varies according to a function of certain covariates.