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Kaizheng Wang

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8 papers
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8

AAAI Conference 2026 Conference Paper

Credal Ensemble Distillation for Uncertainty Quantification

  • Kaizheng Wang
  • Fabio Cuzzolin
  • David Moens
  • Hans Hallez

Deep ensembles (DE) have emerged as a powerful approach for quantifying predictive uncertainty and distinguishing its aleatoric and epistemic components, thereby enhancing model robustness and reliability. However, their high computational and memory costs during inference pose significant challenges for wide practical deployment. To overcome this issue, we propose credal ensemble distillation (CED), a novel framework that compresses a DE into a single model, CREDIT, for classification tasks. Instead of a single softmax probability distribution, CREDIT predicts class-wise probability intervals that define a credal set, a convex set of probability distributions, for uncertainty quantification. Empirical results on out-of-distribution detection benchmarks demonstrate that CED achieves superior or comparable uncertainty estimation compared to several existing baselines, while substantially reducing inference overhead compared to DE.

ICLR Conference 2025 Conference Paper

Credal Wrapper of Model Averaging for Uncertainty Estimation in Classification

  • Kaizheng Wang
  • Fabio Cuzzolin
  • Keivan Shariatmadar
  • David Moens
  • Hans Hallez

This paper presents an innovative approach, called credal wrapper, to formulating a credal set representation of model averaging for Bayesian neural networks (BNNs) and deep ensembles (DEs), capable of improving uncertainty estimation in classification tasks. Given a finite collection of single predictive distributions derived from BNNs or DEs, the proposed credal wrapper approach extracts an upper and a lower probability bound per class, acknowledging the epistemic uncertainty due to the availability of a limited amount of distributions. Such probability intervals over classes can be mapped on a convex set of probabilities (a credal set) from which, in turn, a unique prediction can be obtained using a transformation called intersection probability transformation. In this article, we conduct extensive experiments on several out-of-distribution (OOD) detection benchmarks, encompassing various dataset pairs (CIFAR10/100 vs SVHN/Tiny-ImageNet, CIFAR10 vs CIFAR10-C, CIFAR100 vs CIFAR100-C and ImageNet vs ImageNet-O) and using different network architectures (such as VGG16, ResNet-18/50, EfficientNet B2, and ViT Base). Compared to the BNN and DE baselines, the proposed credal wrapper method exhibits superior performance in uncertainty estimation and achieves a lower expected calibration error on corrupted data.

ICLR Conference 2025 Conference Paper

Random-Set Neural Networks

  • Shireen Kudukkil Manchingal
  • Muhammad Mubashar
  • Kaizheng Wang
  • Keivan Shariatmadar
  • Fabio Cuzzolin

Machine learning is increasingly deployed in safety-critical domains where erroneous predictions may lead to potentially catastrophic consequences, highlighting the need for learning systems to be aware of how confident they are in their own predictions: in other words, 'to know when they do not know’. In this paper, we propose a novel Random-Set Neural Network (RS-NN) approach to classification which predicts *belief functions* (rather than classical probability vectors) over the class list using the mathematics of *random sets*, i.e., distributions over the collection of *sets* of classes. RS-NN encodes the 'epistemic' uncertainty induced by training sets that are insufficiently representative or limited in size via the size of the convex set of probability vectors associated with a predicted belief function. Our approach outperforms state-of-the-art Bayesian and Ensemble methods in terms of accuracy, uncertainty estimation and out-of-distribution (OoD) detection on multiple benchmarks (CIFAR-10 vs SVHN/Intel-Image, MNIST vs FMNIST/KMNIST, ImageNet vs ImageNet-O). RS-NN also scales up effectively to large-scale architectures (e.g. WideResNet-28-10, VGG16, Inception V3, EfficientNetB2 and ViT-Base-16), exhibits remarkable robustness to adversarial attacks and can provide statistical guarantees in a conformal learning setting.

ICML Conference 2025 Conference Paper

Uncertainty Quantification for LLM-Based Survey Simulations

  • Chengpiao Huang
  • Yuhang Wu
  • Kaizheng Wang

We investigate the use of large language models (LLMs) to simulate human responses to survey questions, and perform uncertainty quantification to gain reliable insights. Our approach converts imperfect, LLM-simulated responses into confidence sets for population parameters of human responses, addressing the distribution shift between the simulated and real populations. A key innovation lies in determining the optimal number of simulated responses: too many produce overly narrow confidence sets with poor coverage, while too few yield excessively loose estimates. To resolve this, our method adaptively selects the simulation sample size, ensuring valid average-case coverage guarantees. It is broadly applicable to any LLM, irrespective of its fidelity, and any procedure for constructing confidence sets. Additionally, the selected sample size quantifies the degree of misalignment between the LLM and the target human population. We illustrate our method on real datasets and LLMs.

NeurIPS Conference 2024 Conference Paper

Credal Deep Ensembles for Uncertainty Quantification

  • Kaizheng Wang
  • Fabio Cuzzolin
  • Shireen K. Manchingal
  • Keivan Shariatmadar
  • David Moens
  • Hans Hallez

This paper introduces an innovative approach to classification called Credal Deep Ensembles (CreDEs), namely, ensembles of novel Credal-Set Neural Networks (CreNets). CreNets are trained to predict a lower and an upper probability bound for each class, which, in turn, determine a convex set of probabilities (credal set) on the class set. The training employs a loss inspired by distributionally robust optimization which simulates the potential divergence of the test distribution from the training distribution, in such a way that the width of the predicted probability interval reflects the epistemic uncertainty about the future data distribution. Ensembles can be constructed by training multiple CreNets, each associated with a different random seed, and averaging the outputted intervals. Extensive experiments are conducted on various out-of-distributions (OOD) detection benchmarks (CIFAR10/100 vs SVHN/Tiny-ImageNet, CIFAR10 vs CIFAR10-C, ImageNet vs ImageNet-O) and using different network architectures (ResNet50, VGG16, and ViT Base). Compared to Deep Ensemble baselines, CreDEs demonstrate higher test accuracy, lower expected calibration error, and significantly improved epistemic uncertainty estimation.

ICML Conference 2024 Conference Paper

Model Assessment and Selection under Temporal Distribution Shift

  • Elise Han
  • Chengpiao Huang
  • Kaizheng Wang

We investigate model assessment and selection in a changing environment, by synthesizing datasets from both the current time period and historical epochs. To tackle unknown and potentially arbitrary temporal distribution shift, we develop an adaptive rolling window approach to estimate the generalization error of a given model. This strategy also facilitates the comparison between any two candidate models by estimating the difference of their generalization errors. We further integrate pairwise comparisons into a single-elimination tournament, achieving near-optimal model selection from a collection of candidates. Theoretical analyses and empirical experiments underscore the adaptivity of our proposed methods to the non-stationarity in data.

NeurIPS Conference 2020 Conference Paper

Efficient Clustering for Stretched Mixtures: Landscape and Optimality

  • Kaizheng Wang
  • Yuling Yan
  • Mateo Diaz

This paper considers a canonical clustering problem where one receives unlabeled samples drawn from a balanced mixture of two elliptical distributions and aims for a classifier to estimate the labels. Many popular methods including PCA and k-means require individual components of the mixture to be somewhat spherical, and perform poorly when they are stretched. To overcome this issue, we propose a non-convex program seeking for an affine transform to turn the data into a one-dimensional point cloud concentrating around -1 and 1, after which clustering becomes easy. Our theoretical contributions are two-fold: (1) we show that the non-convex loss function exhibits desirable geometric properties when the sample size exceeds some constant multiple of the dimension, and (2) we leverage this to prove that an efficient first-order algorithm achieves near-optimal statistical precision without good initialization. We also propose a general methodology for clustering with flexible choices of feature transforms and loss objectives.

ICML Conference 2018 Conference Paper

Implicit Regularization in Nonconvex Statistical Estimation: Gradient Descent Converges Linearly for Phase Retrieval and Matrix Completion

  • Cong Ma 0001
  • Kaizheng Wang
  • Yuejie Chi
  • Yuxin Chen 0002

Recent years have seen a flurry of activities in designing provably efficient nonconvex optimization procedures for solving statistical estimation problems. For various problems like phase retrieval or low-rank matrix completion, state-of-the-art nonconvex procedures require proper regularization (e. g. trimming, regularized cost, projection) in order to guarantee fast convergence. When it comes to vanilla procedures such as gradient descent, however, prior theory either recommends highly conservative learning rates to avoid overshooting, or completely lacks performance guarantees. This paper uncovers a striking phenomenon in several nonconvex problems: even in the absence of explicit regularization, gradient descent follows a trajectory staying within a basin that enjoys nice geometry, consisting of points incoherent with the sampling mechanism. This “implicit regularization” feature allows gradient descent to proceed in a far more aggressive fashion without overshooting, which in turn results in substantial computational savings. Focusing on two statistical estimation problems, i. e. solving random quadratic systems of equations and low-rank matrix completion, we establish that gradient descent achieves near-optimal statistical and computational guarantees without explicit regularization. As a byproduct, for noisy matrix completion, we demonstrate that gradient descent enables optimal control of both entrywise and spectral-norm errors.

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