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Exact and Approximate Conformal Inference for Multi-Output Regression

Abstract

It is common in machine learning to estimate a response yy given covariate information xx. However, these predictions alone do not quantify any uncertainty associated with said predictions. One way to overcome this deficiency is with conformal inference methods, which construct a set containing the unobserved response yy with a prescribed probability. Unfortunately, even with a one-dimensional response, conformal inference is computationally expensive despite recent encouraging advances. In this paper, we explore multi-output regression, delivering exact derivations of conformal inference pp-values when the predictive model can be described as a linear function of yy. Additionally, we propose \texttt{unionCP} and a multivariate extension of \texttt{rootCP} as efficient ways of approximating the conformal prediction region for a wide array of multi-output predictors, both linear and nonlinear, while preserving computational advantages. We also provide both theoretical and empirical evidence of the effectiveness of these methods using both real-world and simulated data.

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