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Bayesian Hierarchical Mixtures of Experts (1212.2447v1)

Published 19 Oct 2012 in cs.LG and stat.ML

Abstract: The Hierarchical Mixture of Experts (HME) is a well-known tree-based model for regression and classification, based on soft probabilistic splits. In its original formulation it was trained by maximum likelihood, and is therefore prone to over-fitting. Furthermore the maximum likelihood framework offers no natural metric for optimizing the complexity and structure of the tree. Previous attempts to provide a Bayesian treatment of the HME model have relied either on ad-hoc local Gaussian approximations or have dealt with related models representing the joint distribution of both input and output variables. In this paper we describe a fully Bayesian treatment of the HME model based on variational inference. By combining local and global variational methods we obtain a rigourous lower bound on the marginal probability of the data under the model. This bound is optimized during the training phase, and its resulting value can be used for model order selection. We present results using this approach for a data set describing robot arm kinematics.

Citations (163)

Summary

Overview of Bayesian Hierarchical Mixtures of Experts

The paper presents a comprehensive Bayesian framework for Hierarchical Mixtures of Experts (HME), using variational inference methods to overcome several limitations inherent in the maximum likelihood approach. This methodology addresses the typical issue of overfitting associated with HME parameters by exploring a fully Bayesian treatment, thereby providing a more reliable mechanism for model complexity and tree structure optimization. The paper also proposes rigorous lower bounds on the marginal probability of data under the model, which facilitates model order selection. Empirical results demonstrate the efficacy of the proposed approach for complex data sets, including those related to robot arm kinematics.

Methodological Advances

The primary methodological advancement in this paper is the formulation of a fully Bayesian treatment of the HME model using variational inference. Traditional maximum likelihood approaches to HMEs are susceptible to overfitting due to their large parameter space, and they lack a principled method for determining the model's complexity or topology. By introducing prior distributions over the model parameters, the authors overcome these limitations, although exact Bayesian inference remains intractable.

The authors navigate these challenges by leveraging deterministic approximation via variational methods. This approach constructs a tractable, rigorous lower bound on the model's log marginal likelihood. Notably, the paper addresses complexities introduced by the gating nodes' logistic sigmoid functions through a variational bounding technique, restoring conjugacy and computational feasibility to the Bayesian model.

Results and Validation

The paper's experimental validation exhibits the superiority of Bayesian HME over conventional methods like neural networks trained via least squares, especially in scenarios involving multimodal distributions. The robotic arm kinematics data highlights the potency of the HME model in efficiently managing these complex, multimodal inverse problems.

Moreover, the paper's results indicate that the Bayesian approach offers a tangible improvement in model selection processes. Through exhaustive model evaluation using the marginal likelihood lower bound, the authors effectively demonstrate the concept of "Ockham hill," wherein optimal model architecture is revealed by balancing data fit and complexity penalty.

Implications and Future Directions

The proposed Bayesian framework for HME holds significant implications for domains requiring robust regression and classification models capable of handling complex, multimodal data distributions. This not only enhances predictive performance but also provides a principled approach for model optimization.

Looking forward, the paper's methodology could fuel advancements in the application of mixture models across various AI and machine learning domains. The handling of local maxima within variational methods remains a pertinent area of research, with potential exploration into hybrid methods and advanced initialization strategies promising to further refine model optimization.

Conclusion

In summary, the paper contributes a novel Bayesian approach to the HME model, offering substantial methodological improvements over traditional frameworks. The rigorous use of variational inference ensures tractable computations while effectively mitigating overfitting risks and facilitating optimal model selection. This work lays a formidable foundation for future research and application in complex machine learning tasks.