mlsanityData to 7 Oct 2026

Pitfalls and Remedies for Multi-Task Bayesian Optimization

arXiv 2607.09073 ↗First posted 10 Jul 2026cs.LGcited by 0

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Abstract (arXiv)

Bayesian optimization routinely warm-starts a target experiment with data from related source tasks, and the multi-task Gaussian process is the textbook surrogate for the job. We revisit this default in a controlled setting and find that it misestimates the cross-task correlation even in the simplest non-trivial case, affinely related source and target tasks, where a working transfer learning method should obviously succeed. We trace the failure to two independent structural mechanisms. Per-task standardization, the textbook fix for the affine slice ambiguity, propagates a finite-sample alignment error into the recovered correlation. The marginal likelihood itself identifies the correlation only at a per-sample rate that a Gaussian process at non-overlapping designs further dilutes. We propose three conservative remedies that follow from the analysis: promoting per-task means and scales to model parameters, restricting the task covariance to non-negative correlations, and co-locating part of the source and target designs. Across synthetic multi-task problems and surrogate-based hyperparameter tuning transfer, these remedies recover the target-only baseline on the simple instances, while the broader failure persists on harder instances and across most rank-based and latent-context variants.

Key facts. No citing papers in the map yet (data through 7 Oct 2026). Builds on 12 of its 34 references that are in the map. First posted on arXiv 10 Jul 2026.

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References · 12

  1. 2018A Tutorial on Bayesian Optimizationcited by 734
  2. 2018GPyTorch: Blackbox Matrix-Matrix Gaussian Process Inference with GPU Accelerationcited by 603
  3. 2018Characterizing and Avoiding Negative Transfercited by 226
  4. 2023Unexpected Improvements to Expected Improvement for Bayesian Optimizationcited by 144
  5. 2021HPOBench: A Collection of Reproducible Multi-Fidelity Benchmark Problems for HPOcited by 111
  6. 2024Vanilla Bayesian Optimization Performs Great in High Dimensionscited by 87
  7. 2016Multi-Information Source Optimizationcited by 83
  8. 2021HPO-B: A Large-Scale Reproducible Benchmark for Black-Box HPO based on OpenMLcited by 75
  9. 2019Meta-Learning Acquisition Functions for Transfer Learning in Bayesian Optimizationcited by 70
  10. 2021Pre-trained Gaussian Processes for Bayesian Optimizationcited by 63
  11. 2023Increasing the Scope as You Learn: Adaptive Bayesian Optimization in Nested Subspacescited by 50
  12. 2025ADMIRE-BayesOpt: Accelerated Data MIxture RE-weighting for Language Models with Bayesian Optimizationcited by 4

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