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Gaussian Latent Representations for Uncertainty Estimation using Mahalanobis Distance in Deep Classifiers
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Recent works show that the data distribution in a network's latent space is useful for estimating classification uncertainty and detecting Out-of-distribution (OOD) samples. To obtain a well-regularized latent space that is conducive for uncertainty estimation, existing methods bring in significant changes to model architectures and training procedures. In this paper, we present a lightweight, fast, and high-performance regularization method for Mahalanobis distance-based uncertainty prediction, and that requires minimal changes to the network's architecture. To derive Gaussian latent representation favourable for Mahalanobis Distance calculation, we introduce a self-supervised representation learning method that separates in-class representations into multiple Gaussians. Classes with non-Gaussian representations are automatically identified and dynamically clustered into multiple new classes that are approximately Gaussian. Evaluation on standard OOD benchmarks shows that our method achieves state-of-the-art results on OOD detection with minimal inference time, and is very competitive on predictive probability calibration. Finally, we show the applicability of our method to a real-life computer vision use case on microorganism classification.
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Cited by 1 Pith paper
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ElemeNet: Multiscale Molecular Machine Learning with Uncertainty Quantification Across the Periodic Table
ElemeNet is a unified ML software package for molecular property prediction across elements 1-100 with built-in uncertainty quantification and competitive benchmarks on diverse chemistry datasets.
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