mlsanityData to 7 Oct 2026

HPO-B: A Large-Scale Reproducible Benchmark for Black-Box HPO based on OpenML

arXiv 2106.06257 ↗First posted 11 Jun 2021cs.LGcited by 75

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Abstract (arXiv)

Hyperparameter optimization (HPO) is a core problem for the machine learning community and remains largely unsolved due to the significant computational resources required to evaluate hyperparameter configurations. As a result, a series of recent related works have focused on the direction of transfer learning for quickly fine-tuning hyperparameters on a dataset. Unfortunately, the community does not have a common large-scale benchmark for comparing HPO algorithms. Instead, the de facto practice consists of empirical protocols on arbitrary small-scale meta-datasets that vary inconsistently across publications, making reproducibility a challenge. To resolve this major bottleneck and enable a fair and fast comparison of black-box HPO methods on a level playing field, we propose HPO-B, a new large-scale benchmark in the form of a collection of meta-datasets. Our benchmark is assembled and preprocessed from the OpenML repository and consists of 176 search spaces (algorithms) evaluated sparsely on 196 datasets with a total of 6.4 million hyperparameter evaluations. For ensuring reproducibility on our benchmark, we detail explicit experimental protocols, splits, and evaluation measures for comparing methods for both non-transfer, as well as, transfer learning HPO.

Key facts. Cited by 75 papers in the map (data through 7 Oct 2026). Builds on 14 of its 47 references that are in the map. First posted on arXiv 11 Jun 2021.

Builds on

14 of 47 references.

References · 14

  1. 2016XGBoost: A Scalable Tree Boosting Systemcited by 5,120
  2. 2016Hyperband: A Novel Bandit-Based Approach to Hyperparameter Optimizationcited by 688
  3. 2014OpenML: networked science in machine learningcited by 523
  4. 2020NAS-Bench-201: Extending the Scope of Reproducible Neural Architecture Searchcited by 412
  5. 2019NAS-Bench-101: Towards Reproducible Neural Architecture Searchcited by 340
  6. 2015Scalable Bayesian Optimization Using Deep Neural Networkscited by 284
  7. 2019Meta-Learning Acquisition Functions for Transfer Learning in Bayesian Optimizationcited by 70
  8. 2021Few-Shot Bayesian Optimization with Deep Kernel Surrogatescited by 70
  9. 2019OpenML-Python: an extensible Python API for OpenMLcited by 62
  10. 2019Learning search spaces for Bayesian optimization: Another view of hyperparameter transfer learningcited by 50
  11. 2019Dataset2Vec: Learning Dataset Meta-Featurescited by 37
  12. 2019Hyp-RL : Hyperparameter Optimization by Reinforcement Learningcited by 36
2 more
  1. 2018Automatic Exploration of Machine Learning Experiments on OpenMLcited by 13
  2. 2019Achieving Robustness to Aleatoric Uncertainty with Heteroscedastic Bayesian Optimisationcited by 11

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Cited by year (2026 to 7 Oct)

Citing papers per year: 2021: 5; 2022: 7; 2023: 14; 2024: 16; 2025: 18; 2026: 15.

75 papers.

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  1. 2021Hyperparameter Optimization: Foundations, Algorithms, Best Practices and Open Challengescited by 143
  2. 2024Large Language Models to Enhance Bayesian Optimizationcited by 127
  3. 2021HPOBench: A Collection of Reproducible Multi-Fidelity Benchmark Problems for HPOcited by 111
  4. 2022Towards Learning Universal Hyperparameter Optimizers with Transformerscited by 81
  5. 2023PFNs4BO: In-Context Learning for Bayesian Optimizationcited by 70
  6. 2023MLCopilot: Unleashing the Power of Large Language Models in Solving Machine Learning Taskscited by 66
  7. 2021Pre-trained Gaussian Processes for Bayesian Optimizationcited by 63
  8. 2021YAHPO Gym -- An Efficient Multi-Objective Multi-Fidelity Benchmark for Hyperparameter Optimizationcited by 61
  9. 2022AMLB: an AutoML Benchmarkcited by 55
  10. 2024LLaMoCo: Instruction Tuning of Large Language Models for Optimization Code Generationcited by 45
  11. 2021LassoBench: A High-Dimensional Hyperparameter Optimization Benchmark Suite for Lassocited by 41
  12. 2022NAS-Bench-Suite: NAS Evaluation is (Now) Surprisingly Easycited by 36
38 more
  1. 2023Discovering Attention-Based Genetic Algorithms via Meta-Black-Box Optimizationcited by 33
  2. 2023End-to-End Meta-Bayesian Optimisation with Transformer Neural Processescited by 31
  3. 2024Symbol: Generating Flexible Black-Box Optimizers through Symbolic Equation Learningcited by 22
  4. 2024Amortized Bayesian Experimental Design for Decision-Makingcited by 20
  5. 2023Quick-Tune: Quickly Learning Which Pretrained Model to Finetune and Howcited by 17
  6. 2023Framework and Benchmarks for Combinatorial and Mixed-variable Bayesian Optimizationcited by 15
  7. 2024ConfigX: Modular Configuration for Evolutionary Algorithms via Multitask Reinforcement Learningcited by 15
  8. 2025Adaptive Kernel Design for Bayesian Optimization Is a Piece of CAKE with LLMscited by 15
  9. 2024Reinforced In-Context Black-Box Optimizationcited by 14
  10. 2024Offline Multi-Objective Optimizationcited by 14
  11. 2022Zero-Shot AutoML with Pretrained Modelscited by 13
  12. 2026The Last Human-Written Paper: Agent-Native Research Artifactscited by 12
  13. 2023Transfer Learning for Bayesian Optimization on Heterogeneous Search Spacescited by 9
  14. 2025MetaBox-v2: A Unified Benchmark Platform for Meta-Black-Box Optimizationcited by 9
  15. 2025ALINE: Joint Amortization for Bayesian Inference and Active Data Acquisitioncited by 8
  16. 2024Reshuffling Resampling Splits Can Improve Generalization of Hyperparameter Optimizationcited by 7
  17. 2024Monte Carlo Tree Search based Space Transfer for Black-box Optimizationcited by 7
  18. 2025PABBO: Preferential Amortized Black-Box Optimizationcited by 7
  19. 2022FedHPO-B: A Benchmark Suite for Federated Hyperparameter Optimizationcited by 6
  20. 2022Task Selection for AutoML System Evaluationcited by 6
  21. 2024EARL-BO: Reinforcement Learning for Multi-Step Lookahead, High-Dimensional Bayesian Optimizationcited by 6
  22. 2025Instance Generation for Meta-Black-Box Optimization through Latent Space Reverse Engineeringcited by 6
  23. 2023Deep Ranking Ensembles for Hyperparameter Optimizationcited by 5
  24. 2025Dimension Agnostic Neural Processescited by 5
  25. 2025DesignX: Human-Competitive Algorithm Designer for Black-Box Optimizationcited by 5
  26. 2022HyperBO+: Pre-training a universal prior for Bayesian optimization with hierarchical Gaussian processescited by 4
  27. 2023NeuroEvoBench: Benchmarking Evolutionary Optimizers for Deep Learning Applicationscited by 4
  28. 2025Hyperparameter Optimization via Interacting with Probabilistic Circuitscited by 4
  29. 2025BBOPlace-Bench: Benchmarking Black-Box Optimization for Chip Placementcited by 4
  30. 2024ARLBench: Flexible and Efficient Benchmarking for Hyperparameter Optimization in Reinforcement Learningcited by 3
  31. 2025carps: A Framework for Comparing N Hyperparameter Optimizers on M Benchmarkscited by 3
  32. 2025None To Optima in Few Shots: Bayesian Optimization with MDP Priorscited by 3
  33. 2023Deep Pipeline Embeddings for AutoMLcited by 2
  34. 2023Python Wrapper for Simulating Multi-Fidelity Optimization on HPO Benchmarks without Any Waitcited by 2
  35. 2023MALIBO: Meta-learning for Likelihood-free Bayesian Optimizationcited by 2
  36. 2023Efficient Bayesian Optimization with Deep Kernel Learning and Transformer Pre-trained on Multiple Heterogeneous Datasetscited by 2
  37. 2024Fast Benchmarking of Asynchronous Multi-Fidelity Optimization on Zero-Cost Benchmarkscited by 2
  38. 2024LMEMs for post-hoc analysis of HPO Benchmarkingcited by 2

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