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Hyperband: A Novel Bandit-Based Approach to Hyperparameter Optimization (1603.06560v4)

Published 21 Mar 2016 in cs.LG and stat.ML

Abstract: Performance of machine learning algorithms depends critically on identifying a good set of hyperparameters. While recent approaches use Bayesian optimization to adaptively select configurations, we focus on speeding up random search through adaptive resource allocation and early-stopping. We formulate hyperparameter optimization as a pure-exploration non-stochastic infinite-armed bandit problem where a predefined resource like iterations, data samples, or features is allocated to randomly sampled configurations. We introduce a novel algorithm, Hyperband, for this framework and analyze its theoretical properties, providing several desirable guarantees. Furthermore, we compare Hyperband with popular Bayesian optimization methods on a suite of hyperparameter optimization problems. We observe that Hyperband can provide over an order-of-magnitude speedup over our competitor set on a variety of deep-learning and kernel-based learning problems.

Citations (2,143)

Summary

  • The paper introduces Hyperband, a bandit-based algorithm that adaptively allocates resources to rapidly identify promising hyperparameter configurations.
  • The method generalizes successive halving by employing multiple brackets, significantly reducing computational costs compared to traditional Bayesian optimization approaches.
  • Empirical evaluations reveal up to 30x speedups on various ML tasks, underscoring Hyperband’s potential for efficient and scalable hyperparameter tuning.

Hyperband: A Novel Bandit-Based Approach to Hyperparameter Optimization

The paper "Hyperband: A Novel Bandit-Based Approach to Hyperparameter Optimization" by Li et al. addresses a critical aspect of ML: hyperparameter optimization (HPO). The performance of ML algorithms heavily depends on finding optimal hyperparameter configurations, which is commonly achieved through methods like random search or grid search. In response to the computational inefficiencies associated with these brute-force methods, the authors propose Hyperband, a bandit-based algorithm designed to accelerate hyperparameter optimization by adaptively allocating resources and leveraging early-stopping strategies.

Problem Context and Existing Approaches

Hyperparameter optimization is framed as a necessary task that significantly impacts the performance of ML models. Traditional optimization approaches are either non-adaptive, evaluating all configurations to the same extent (e.g., random search), or adaptive, attempting to predict and early-stop poor configurations (e.g., Bayesian optimization). The paper emphasizes the paramount challenge of adaptively allocating resources to configurations of unknown quality, without prior assumptions about the function's smoothness or noisiness.

Theoretical Framework and Algorithm

The paper formulates HPO as a pure-exploration, non-stochastic, infinite-armed bandit (NIAB) problem. Each hyperparameter configuration is treated as an arm, with iterative resources allocated to sample validation loss sequences. The goal is to identify configurations with minimal validation loss using the least amount of computational resources. The authors define rigorous theoretical properties and derive bounds for the proposed Hyperband algorithm, anchored on the convergence properties of the validation losses.

Hyperband builds on the concept of SuccessiveHalving, which repeatedly allocates resources to a fixed set of configurations, progressively halving the number of configurations while increasing their allocated resources. Hyperband generalizes this by considering multiple SuccessiveHalving brackets with different tradeoffs between the breadth (number of configurations) and depth (resource allocation per configuration).

Empirical Validation

The authors validate Hyperband across various ML tasks, employing resources such as iterations, data subsampling, and feature subsampling. Their experimental setup includes tuning neural networks on CIFAR-10, SVHN, and MNIST datasets, as well as using synthetic benchmarks to illustrate the theoretical efficiency of Hyperband compared to state-of-the-art Bayesian optimization techniques such as SMAC, TPE, and Spearmint.

One key metric is computational efficiency. Hyperband consistently excels, showcasing speedups up to 30x over Bayesian methods in specific tasks involving convolutional neural networks. The empirical results underline the practical viability of Hyperband, especially in scenarios where early identification and elimination of poor configurations can lead to significant computational savings.

Key Findings and Numerical Results

The notable numerical results reveal that Hyperband can outperform Bayesian optimization methods by an order of magnitude in speed while maintaining competitive, if not superior, performance in identifying optimal hyperparameters. For example, Hyperband achieved dramatic speedups on CIFAR-10 and MRBI datasets, reducing the time to achieve low test errors by factors exceeding 10x compared to other adaptive methods.

Theoretical Implications and Practical Impact

Hyperband's theoretical contributions include the introduction of the NIAB problem for HPO, providing a foundation for future research in resource-adaptive algorithmic design. Practically, Hyperband's minimal assumptions about the underlying validation loss landscapes make it broadly applicable across various ML models and tasks without extensive parameter tuning.

Future Directions

The implications for future developments in HPO and AI at large are profound. Hyperband's robust framework can be extended to incorporate:

  1. Meta-learning: Using historical HPO data to inform better initial hyperparameter distributions.
  2. Parallelization: Enhancing Hyperband for distributed computing environments, augmenting its scalability.
  3. Combining Methods: Integrating Hyperband with advanced Bayesian optimization techniques to further refine its sampling efficiency.

Conclusion

In summary, the Hyperband algorithm proposed by Li et al. represents a significant stride toward efficient hyperparameter optimization, merging the theoretical rigor of bandit-based approaches with practical, scalable computational strategies. Its empirical validations on multiple datasets and tasks not only reaffirm its competitive edge but also spotlight its versatility and adaptability across diverse ML applications. As ML models continue to grow in complexity, methods like Hyperband will be instrumental in automating and accelerating the optimization processes that underpin their performance.

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