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Variational Inference with Coverage Guarantees in Simulation-Based Inference

ICML 2024 · Probabilistic and scientific modeling › Uncertainty and Gaussian processes · approach: Variational Bayesian deep learning · 0 citations (OpenAlex)

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Proposes CANVI, which wraps amortized variational posteriors with split conformal prediction, selects the most efficient candidate by estimated volume, and recalibrates on a fresh set to give marginal coverage guarantees in simulation-based inference.

Problem

Amortized variational inference in simulation-based inference yields posterior approximations with no guarantees on calibration (coverage), and existing calibration fixes are heuristic or require tuning.

Approach

Apply split conformal prediction with the score 1/q(theta|x) on top of amortized VI posteriors, pick the candidate approximator minimizing estimated predictive efficiency (Lebesgue volume of regions), then recalibrate on a separate dataset so that marginal coverage holds after selection; requires only forward-model samples.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
Conformalize the ELBO posteriorELBO posterior · ARCH, target coverage 0.50coverage: 0.0007 -> 0.4970Helped
Conformalize the IWBO posteriorIWBO posterior · ARCH, target coverage 0.95coverage: 0.4074 -> 0.9548Helped
Conformalize the FAVI posteriorFAVI posterior · ARCH, target coverage 0.95coverage: 0.9260 -> 0.9487Helped
Conformalize the ELBO posteriorELBO posterior · SED, target coverage 0.95coverage: 0.6824 -> 0.9499Helped
Conformalize the IWBO posteriorIWBO posterior · SED, target coverage 0.95coverage: 0.9248 -> 0.9510Helped
Conformalize the FAVI posteriorFAVI posterior · SED, target coverage 0.95coverage: 0.9532 -> 0.9461No clear effect
Use 10 mixed samplers instead of only the variational posterior as the volume-estimation sampler (ablation)CANVI volume estimator · ARCHvolume estimate accuracyHelped
Use 10 mixed samplers instead of only the variational posterior as the volume-estimation sampler (ablation)CANVI volume estimator · ARCH, ELBO volume estimateestimated volume: 50.6595 (8.1313) -> 1.4151 (0.2181)Helped
Use 10 mixed samplers instead of only the variational posterior as the volume-estimation sampler (ablation)CANVI volume estimator · ARCH, IWBO volume estimateestimated volume: 69.6484 (2.2495) -> 1.5206 (0.1114)Helped

Surprising findings

Limitations

Experimental setup

Datasets: SBI benchmark tasks (Gaussian Linear, Gaussian Linear Uniform, SLCP with Distractors, Bernoulli GLM Raw, Gaussian Mixtur PROVABGS galaxy spectra simulator

Benchmarks: SBI benchmark tasks ARCH time-series model PROVABGS galaxy spectral energy distributions

Metrics: expected coverage predictive efficiency (expected Lebesgue volume of predictio calibration curves

Baselines: BNRE BNRE C NPE NRE NRE C Ratio BNPE ELBO IWBO FAVI

Builds on: split conformal prediction VFCP (validity-first conformal prediction) FAVI normalizing flows HPD-based conformal calibration

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