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Deep Unsupervised Clustering with Gaussian Mixture Variational Autoencoders (1611.02648v2)

Published 8 Nov 2016 in cs.LG, cs.NE, and stat.ML

Abstract: We study a variant of the variational autoencoder model (VAE) with a Gaussian mixture as a prior distribution, with the goal of performing unsupervised clustering through deep generative models. We observe that the known problem of over-regularisation that has been shown to arise in regular VAEs also manifests itself in our model and leads to cluster degeneracy. We show that a heuristic called minimum information constraint that has been shown to mitigate this effect in VAEs can also be applied to improve unsupervised clustering performance with our model. Furthermore we analyse the effect of this heuristic and provide an intuition of the various processes with the help of visualizations. Finally, we demonstrate the performance of our model on synthetic data, MNIST and SVHN, showing that the obtained clusters are distinct, interpretable and result in achieving competitive performance on unsupervised clustering to the state-of-the-art results.

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Authors (7)
  1. Nat Dilokthanakul (8 papers)
  2. Pedro A. M. Mediano (43 papers)
  3. Marta Garnelo (19 papers)
  4. Matthew C. H. Lee (11 papers)
  5. Hugh Salimbeni (8 papers)
  6. Kai Arulkumaran (23 papers)
  7. Murray Shanahan (46 papers)
Citations (622)

Summary

Deep Unsupervised Clustering with Gaussian Mixture Variational Autoencoders

The paper "Deep Unsupervised Clustering with Gaussian Mixture Variational Autoencoders" presents an innovative approach to leveraging the variational autoencoder (VAE) framework for unsupervised clustering tasks in machine learning. The central premise is the integration of a Gaussian mixture model (GMM) as a prior distribution in VAEs to enhance the clustering capabilities of deep generative models.

Variational Autoencoders and Gaussian Mixtures

Variational autoencoders are a popular generative model combining variational Bayesian methods with neural networks, allowing for scalable and flexible inference. In typical VAEs, an isotropic Gaussian prior is employed over the latent variables, which can lead to disentangled and interpretable representations. However, this imposes a limitation due to its unimodal nature.

This research proposes Gaussian Mixture Variational Autoencoders (GMVAEs) which extend VAEs by incorporating a Gaussian mixture model as the prior. This enables capturing multimodal latent distributions, thereby enhancing the clustering performance. The GMVAE generates a mixture of Gaussians in the latent space, governed by discrete categorical variables.

Addressing Over-Regularisation

The paper identifies over-regularisation as a crucial issue in standard VAEs, manifesting as cluster degeneracy in GMVAEs. This problem arises from the overwhelming influence of the prior regularisation term, which can result in overly simplified latent representations that fail to capture the inherent complexity of the data.

To address this, the authors employ a heuristic known as the minimum information constraint. By controlling the strength of the regularisation term, the model facilitates meaningful clustering while avoiding degenerate solutions where all data points are mapped to a single cluster.

Experimental Evaluation

The paper demonstrates the efficacy of GMVAEs on various datasets: synthetic data, MNIST, and SVHN. The results illustrate that GMVAEs achieve competitive clustering performance, producing distinct and interpretable clusters. Key numerical results include an unsupervised classification accuracy on MNIST that rivals state-of-the-art methods, although not surpassing adversarial approaches, which benefit from a different form of regularisation leveraging adversarial losses.

Theoretical Implications and Future Directions

The integration of GMMs with VAEs enriches the expressive power of unsupervised clustering in generative models. This notion of utilizing more complex priors can potentially be extended to other generative frameworks, offering a pathway to better model hierarchical data structures.

The research invites future exploration into deeper hierarchical models, possibly stacking GMVAEs, and tackling enduring optimisation challenges. Addressing the constraints of the current variational inference in VAEs remains critical for future developments.

Conclusion

This work represents a noteworthy stride in adapting VAEs for clustering tasks by adopting Gaussian mixture models as priors, effectively managing over-regularisation. The insightful adjustments to the VAE framework enable robust unsupervised clustering, illustrating a promising methodology for data-driven discoveries without the need for labeled datasets.

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