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Overfitting Bayesian Mixture Models with an Unknown Number of Components

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  • Zoé van Havre
  • Nicole White
  • Judith Rousseau
  • Kerrie Mengersen

Abstract

This paper proposes solutions to three issues pertaining to the estimation of finite mixture models with an unknown number of components: the non-identifiability induced by overfitting the number of components, the mixing limitations of standard Markov Chain Monte Carlo (MCMC) sampling techniques, and the related label switching problem. An overfitting approach is used to estimate the number of components in a finite mixture model via a Zmix algorithm. Zmix provides a bridge between multidimensional samplers and test based estimation methods, whereby priors are chosen to encourage extra groups to have weights approaching zero. MCMC sampling is made possible by the implementation of prior parallel tempering, an extension of parallel tempering. Zmix can accurately estimate the number of components, posterior parameter estimates and allocation probabilities given a sufficiently large sample size. The results will reflect uncertainty in the final model and will report the range of possible candidate models and their respective estimated probabilities from a single run. Label switching is resolved with a computationally light-weight method, Zswitch, developed for overfitted mixtures by exploiting the intuitiveness of allocation-based relabelling algorithms and the precision of label-invariant loss functions. Four simulation studies are included to illustrate Zmix and Zswitch, as well as three case studies from the literature. All methods are available as part of the R package Zmix, which can currently be applied to univariate Gaussian mixture models.

Suggested Citation

  • Zoé van Havre & Nicole White & Judith Rousseau & Kerrie Mengersen, 2015. "Overfitting Bayesian Mixture Models with an Unknown Number of Components," PLOS ONE, Public Library of Science, vol. 10(7), pages 1-27, July.
  • Handle: RePEc:plo:pone00:0131739
    DOI: 10.1371/journal.pone.0131739
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    1. repec:dau:papers:123456789/6069 is not listed on IDEAS
    2. Lewin Alex & Bochkina Natalia & Richardson Sylvia, 2007. "Fully Bayesian Mixture Model for Differential Gene Expression: Simulations and Model Checks," Statistical Applications in Genetics and Molecular Biology, De Gruyter, vol. 6(1), pages 1-28, December.
    3. James J. Heckman & Christopher R. Taber, 1994. "Econometric Mixture Models and More General Models for Unobservables in Duration Analysis," NBER Technical Working Papers 0157, National Bureau of Economic Research, Inc.
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    Cited by:

    1. Papastamoulis, Panagiotis, 2018. "Overfitting Bayesian mixtures of factor analyzers with an unknown number of components," Computational Statistics & Data Analysis, Elsevier, vol. 124(C), pages 220-234.
    2. Burghardt, Elliot & Sewell, Daniel & Cavanaugh, Joseph, 2022. "Agglomerative and divisive hierarchical Bayesian clustering," Computational Statistics & Data Analysis, Elsevier, vol. 176(C).
    3. Tin Lok James Ng & Andrew Zammit-Mangion, 2024. "Mixture modeling with normalizing flows for spherical density estimation," Advances in Data Analysis and Classification, Springer;German Classification Society - Gesellschaft für Klassifikation (GfKl);Japanese Classification Society (JCS);Classification and Data Analysis Group of the Italian Statistical Society (CLADAG);International Federation of Classification Societies (IFCS), vol. 18(1), pages 103-120, March.
    4. Sylvia Frühwirth-Schnatter & Gertraud Malsiner-Walli, 2019. "From here to infinity: sparse finite versus Dirichlet process mixtures in model-based clustering," Advances in Data Analysis and Classification, Springer;German Classification Society - Gesellschaft für Klassifikation (GfKl);Japanese Classification Society (JCS);Classification and Data Analysis Group of the Italian Statistical Society (CLADAG);International Federation of Classification Societies (IFCS), vol. 13(1), pages 33-64, March.

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