Regression trees are one of the oldest forms of AI models, and their predictions can be made without a calculator, which makes them broadly useful, particularly for high-stakes applications. Within the large literature on regression trees, there has been little effort towards full provable optimization, mainly due to the computational hardness of the problem. This work proposes a dynamic-programming-with-bounds approach to the construction of provably-optimal sparse regression trees. We leverage a novel lower bound based on an optimal solution to the k-Means clustering algorithm in 1-dimension over the set of labels. We are often able to find optimal sparse trees in seconds, even for challenging datasets that involve large numbers of samples and highly-correlated features.
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Functional quadratic regression models postulate a polynomial relationship between a scalar response rather than a linear one. As in functional linear regression, vertical and specially high-leverage outliers may affect the classical estimators. For that reason, the proposal of robust procedures providing reliable estimators in such situations is an important issue. Taking into account that the functional polynomial model is equivalent to a regression model that is a polynomial of the same order in the functional principal component scores of the predictor processes, our proposal combines robust estimators of the principal directions with robust regression estimators based on a bounded loss function and a preliminary residual scale estimator. Fisher-consistency of the proposed method is derived under mild assumptions. The results of a numerical study show, for finite samples, the benefits of the robust proposal over the one based on sample principal directions and least squares. The usefulness of the proposed approach is also illustrated through the analysis of a real data set which reveals that when the potential outliers are removed the classical and robust methods behave very similarly.
Symbolic Regression (SR) algorithms attempt to learn analytic expressions which fit data accurately and in a highly interpretable manner. Conventional SR suffers from two fundamental issues which we address here. First, these methods search the space stochastically (typically using genetic programming) and hence do not necessarily find the best function. Second, the criteria used to select the equation optimally balancing accuracy with simplicity have been variable and subjective. To address these issues we introduce Exhaustive Symbolic Regression (ESR), which systematically and efficiently considers all possible equations -- made with a given basis set of operators and up to a specified maximum complexity -- and is therefore guaranteed to find the true optimum (if parameters are perfectly optimised) and a complete function ranking subject to these constraints. We implement the minimum description length principle as a rigorous method for combining these preferences into a single objective. To illustrate the power of ESR we apply it to a catalogue of cosmic chronometers and the Pantheon+ sample of supernovae to learn the Hubble rate as a function of redshift, finding $\sim$40 functions (out of 5.2 million trial functions) that fit the data more economically than the Friedmann equation. These low-redshift data therefore do not uniquely prefer the expansion history of the standard model of cosmology. We make our code and full equation sets publicly available.
Datasets with sheer volume have been generated from fields including computer vision, medical imageology, and astronomy whose large-scale and high-dimensional properties hamper the implementation of classical statistical models. To tackle the computational challenges, one of the efficient approaches is subsampling which draws subsamples from the original large datasets according to a carefully-design task-specific probability distribution to form an informative sketch. The computation cost is reduced by applying the original algorithm to the substantially smaller sketch. Previous studies associated with subsampling focused on non-regularized regression from the computational efficiency and theoretical guarantee perspectives, such as ordinary least square regression and logistic regression. In this article, we introduce a randomized algorithm under the subsampling scheme for the Elastic-net regression which gives novel insights into L1-norm regularized regression problem. To effectively conduct consistency analysis, a smooth approximation technique based on alpha absolute function is firstly employed and theoretically verified. The concentration bounds and asymptotic normality for the proposed randomized algorithm are then established under mild conditions. Moreover, an optimal subsampling probability is constructed according to A-optimality. The effectiveness of the proposed algorithm is demonstrated upon synthetic and real data datasets.
The simultaneous estimation of multiple unknown parameters lies at heart of a broad class of important problems across science and technology. Currently, the state-of-the-art performance in the such problems is achieved by nonparametric empirical Bayes methods. However, these approaches still suffer from two major issues. First, they solve a frequentist problem but do so by following Bayesian reasoning, posing a philosophical dilemma that has contributed to somewhat uneasy attitudes toward empirical Bayes methodology. Second, their computation relies on certain density estimates that become extremely unreliable in some complex simultaneous estimation problems. In this paper, we study these issues in the context of the canonical Gaussian sequence problem. We propose an entirely frequentist alternative to nonparametric empirical Bayes methods by establishing a connection between simultaneous estimation and penalized nonparametric regression. We use flexible regularization strategies, such as shape constraints, to derive accurate estimators without appealing to Bayesian arguments. We prove that our estimators achieve asymptotically optimal regret and show that they are competitive with or can outperform nonparametric empirical Bayes methods in simulations and an analysis of spatially resolved gene expression data.
This paper investigates the asymptotic distribution of the maximum-likelihood estimate (MLE) in multinomial logistic models in the high-dimensional regime where dimension and sample size are of the same order. While classical large-sample theory provides asymptotic normality of the MLE under certain conditions, such classical results are expected to fail in high-dimensions as documented for the binary logistic case in the seminal work of Sur and Cand\`es [2019]. We address this issue in classification problems with 3 or more classes, by developing asymptotic normality and asymptotic chi-square results for the multinomial logistic MLE (also known as cross-entropy minimizer) on null covariates. Our theory leads to a new methodology to test the significance of a given feature. Extensive simulation studies on synthetic data corroborate these asymptotic results and confirm the validity of proposed p-values for testing the significance of a given feature.
This article describes an R package bqror that estimates Bayesian quantile regression for ordinal models introduced in Rahman (2016). The paper classifies ordinal models into two types and offers computationally efficient, yet simple, Markov chain Monte Carlo (MCMC) algorithms for estimating ordinal quantile regression. The generic ordinal model with 3 or more outcomes (labeled ORI model) is estimated by a combination of Gibbs sampling and Metropolis-Hastings algorithm. Whereas an ordinal model with exactly 3 outcomes (labeled ORII model) is estimated using Gibbs sampling only. In line with the Bayesian literature, we suggest using marginal likelihood for comparing alternative quantile regression models and explain how to compute the same. The models and their estimation procedures are illustrated via multiple simulation studies and implemented in two applications. The article also describes several other functions contained within the bqror package, which are necessary for estimation, inference, and assessing model fit.
Sparse linear regression is a central problem in high-dimensional statistics. We study the correlated random design setting, where the covariates are drawn from a multivariate Gaussian $N(0,\Sigma)$, and we seek an estimator with small excess risk. If the true signal is $t$-sparse, information-theoretically, it is possible to achieve strong recovery guarantees with only $O(t\log n)$ samples. However, computationally efficient algorithms have sample complexity linear in (some variant of) the condition number of $\Sigma$. Classical algorithms such as the Lasso can require significantly more samples than necessary even if there is only a single sparse approximate dependency among the covariates. We provide a polynomial-time algorithm that, given $\Sigma$, automatically adapts the Lasso to tolerate a small number of approximate dependencies. In particular, we achieve near-optimal sample complexity for constant sparsity and if $\Sigma$ has few ``outlier'' eigenvalues. Our algorithm fits into a broader framework of feature adaptation for sparse linear regression with ill-conditioned covariates. With this framework, we additionally provide the first polynomial-factor improvement over brute-force search for constant sparsity $t$ and arbitrary covariance $\Sigma$.
In deep learning, often the training process finds an interpolator (a solution with 0 training loss), but the test loss is still low. This phenomenon, known as benign overfitting, is a major mystery that received a lot of recent attention. One common mechanism for benign overfitting is implicit regularization, where the training process leads to additional properties for the interpolator, often characterized by minimizing certain norms. However, even for a simple sparse linear regression problem $y = \beta^{*\top} x +\xi$ with sparse $\beta^*$, neither minimum $\ell_1$ or $\ell_2$ norm interpolator gives the optimal test loss. In this work, we give a different parametrization of the model which leads to a new implicit regularization effect that combines the benefit of $\ell_1$ and $\ell_2$ interpolators. We show that training our new model via gradient descent leads to an interpolator with near-optimal test loss. Our result is based on careful analysis of the training dynamics and provides another example of implicit regularization effect that goes beyond norm minimization.
Undirected, binary network data consist of indicators of symmetric relations between pairs of actors. Regression models of such data allow for the estimation of effects of exogenous covariates on the network and for prediction of unobserved data. Ideally, estimators of the regression parameters should account for the inherent dependencies among relations in the network that involve the same actor. To account for such dependencies, researchers have developed a host of latent variable network models, however, estimation of many latent variable network models is computationally onerous and which model is best to base inference upon may not be clear. We propose the Probit Exchangeable (PX) model for undirected binary network data that is based on an assumption of exchangeability, which is common to many of the latent variable network models in the literature. The PX model can represent the first two moments of any exchangeable network model. We leverage the EM algorithm to obtain an approximate maximum likelihood estimator of the PX model that is extremely computationally efficient. Using simulation studies, we demonstrate the improvement in estimation of regression coefficients of the proposed model over existing latent variable network models. In an analysis of purchases of politically-aligned books, we demonstrate political polarization in purchase behavior and show that the proposed estimator significantly reduces runtime relative to estimators of latent variable network models, while maintaining predictive performance.
We apply the Hierarchical Autoregressive Neural (HAN) network sampling algorithm to the two-dimensional $Q$-state Potts model and perform simulations around the phase transition at $Q=12$. We quantify the performance of the approach in the vicinity of the first-order phase transition and compare it with that of the Wolff cluster algorithm. We find a significant improvement as far as the statistical uncertainty is concerned at a similar numerical effort. In order to efficiently train large neural networks we introduce the technique of pre-training. It allows to train some neural networks using smaller system sizes and then employing them as starting configurations for larger system sizes. This is possible due to the recursive construction of our hierarchical approach. Our results serve as a demonstration of the performance of the hierarchical approach for systems exhibiting bimodal distributions. Additionally, we provide estimates of the free energy and entropy in the vicinity of the phase transition with statistical uncertainties of the order of $10^{-7}$ for the former and $10^{-3}$ for the latter based on a statistics of $10^6$ configurations.
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