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Approximating Full Conformal Prediction for Neural Network Regression with Gauss-Newton Influence

ICLR 2025 · Learning theory and algorithms › Prediction and decision losses · approach: Probabilistic calibration

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Proposes ACP-GN, an approximate full conformal prediction method for neural network regression that trains once and uses Gauss-Newton influence plus network linearization to get closed-form prediction intervals without a label grid or sample splitting, and SCP-GN, a normalized split-CP variant.

Problem

Full conformal prediction is statistically efficient but requires retraining the network for every test point and candidate label, which is infeasible for deep neural network regression; split-CP avoids this but wastes data and yields non-adaptive intervals.

Approach

Approximate the retraining in full-CP with a single Gauss-Newton influence (Newton-step, rank-one) perturbation of the trained parameters, and linearize the network so the absolute residual is piecewise linear in the candidate label, allowing exact changepoint-based interval construction via conformalized ridge regression without a grid search.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
Use ACP-GN instead of the conformal baselinesneural network regression on limited-data UCI datasets · yacht, boston, and energyaverage prediction interval widthHelped
Use ACP-GN on larger datasetsneural network regression · UCI large datasets, especially facebook_2 at higher target coverageaverage prediction interval widthMixed
Use ACP-GN (split + refine) rather than ACP-GN without splitting and refinement (ablation)neural network regression · UCI datasetscoverage validityHelped
Use ACP-GN (split + refine) rather than ACP-GN without splitting and refinement (ablation)neural network regression · UCI datasetsaverage prediction interval widthHurt
Normalize split-CP residual scores using Gauss-Newton predictive variance (ablation)SCP · UCI datasets and target coverage settingsaverage prediction interval widthHelped
Use studentized rather than add-one-in or leave-one-out nonconformity scores (ablation)ACP-GN · neural network regression experimentsempirical performanceHelped
Use ACP-GN (split + refine) rather than ACP-GN (ablation)bounding-box regression · Oxford-IIIT Pet bounding box localizationconfidence-region volumeHelped
Use ACP-GN rather than conformal baselinesbounding-box regression · Oxford-IIIT Pet bounding box localizationconfidence-region volumeHelped

Surprising findings

Limitations

Experimental setup

Datasets: yacht boston energy wine kin8nm power concrete bike community protein facebook_1 facebook_2

Benchmarks: yacht boston energy bike protein facebook_2 Oxford-IIIT Pet bounding box localization

Metrics: average prediction interval width average coverage confidence region volume

Baselines: Linearized Laplace split conformal prediction conformalized residual fitting conformalized quantile regression

Builds on: conformalized ridge regression Newton-step influence Linearized Laplace split conformal prediction conformalized quantile regression

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