Nested conformal prediction and quantile out-of-bag ensemble methods

Conformal prediction is a popular tool for providing valid prediction sets for classification and regression problems, without relying on any distributional assumptions on the data. While the traditional description of conformal prediction starts with a nonconformity score, we provide an alternate (but equivalent) view that starts with a sequence of nested sets and calibrates them to find a valid prediction set. The nested framework subsumes all nonconformity scores, including recent proposals based on quantile regression and density estimation. While these ideas were originally derived based on sample splitting, our framework seamlessly extends them to other aggregation schemes like cross-conformal, jackknife+ and out-of-bag methods. We use the framework to derive a new algorithm (QOOB, pronounced cube) that combines four ideas: quantile regression, cross-conformalization, ensemble methods and out-of-bag predictions. We develop a computationally efficient implementation of cross-conformal, that is also used by QOOB. In a detailed numerical investigation, QOOB performs either the best or close to the best on all simulated and real datasets.Comment: 38 pages, 5 figures, 8 table

Calibrated Explanations for Regression

Artificial Intelligence (AI) is often an integral part of modern decision support systems (DSSs). The best-performing predictive models used in AI-based DSSs lack transparency. Explainable Artificial Intelligence (XAI) aims to create AI systems that can explain their rationale to human users. Local explanations in XAI can provide information about the causes of individual predictions in terms of feature importance. However, a critical drawback of existing local explanation methods is their inability to quantify the uncertainty associated with a feature's importance. This paper introduces an extension of a feature importance explanation method, Calibrated Explanations (CE), previously only supporting classification, with support for standard regression and probabilistic regression, i.e., the probability that the target is above an arbitrary threshold. The extension for regression keeps all the benefits of CE, such as calibration of the prediction from the underlying model with confidence intervals, uncertainty quantification of feature importance, and allows both factual and counterfactual explanations. CE for standard regression provides fast, reliable, stable, and robust explanations. CE for probabilistic regression provides an entirely new way of creating probabilistic explanations from any ordinary regression model and with a dynamic selection of thresholds. The performance of CE for probabilistic regression regarding stability and speed is comparable to LIME. The method is model agnostic with easily understood conditional rules. An implementation in Python is freely available on GitHub and for installation using pip making the results in this paper easily replicable.Comment: 30 pages, 11 figures (replaced due to omitted author, which is the only change made

Conformal Rule-Based Multi-label Classification

We advocate the use of conformal prediction (CP) to enhance rule-based multi-label classification (MLC). In particular, we highlight the mutual benefit of CP and rule learning: Rules have the ability to provide natural (non-)conformity scores, which are required by CP, while CP suggests a way to calibrate the assessment of candidate rules, thereby supporting better predictions and more elaborate decision making. We illustrate the potential usefulness of calibrated conformity scores in a case study on lazy multi-label rule learning