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arXiv 提交日期: 2026-02-11
📄 Abstract - Domain Knowledge Guided Bayesian Optimization For Autonomous Alignment Of Complex Scientific Instruments

Bayesian Optimization (BO) is a powerful tool for optimizing complex non-linear systems. However, its performance degrades in high-dimensional problems with tightly coupled parameters and highly asymmetric objective landscapes, where rewards are sparse. In such needle-in-a-haystack scenarios, even advanced methods like trust-region BO (TurBO) often lead to unsatisfactory results. We propose a domain knowledge guided Bayesian Optimization approach, which leverages physical insight to fundamentally simplify the search problem by transforming coordinates to decouple input features and align the active subspaces with the primary search axes. We demonstrate this approach's efficacy on a challenging 12-dimensional, 6-crystal Split-and-Delay optical system, where conventional approaches, including standard BO, TuRBO and multi-objective BO, consistently led to unsatisfactory results. When combined with an reverse annealing exploration strategy, this approach reliably converges to the global optimum. The coordinate transformation itself is the key to this success, significantly accelerating the search by aligning input co-ordinate axes with the problem's active subspaces. As increasingly complex scientific instruments, from large telescopes to new spectrometers at X-ray Free Electron Lasers are deployed, the demand for robust high-dimensional optimization grows. Our results demonstrate a generalizable paradigm: leveraging physical insight to transform high-dimensional, coupled optimization problems into simpler representations can enable rapid and robust automated tuning for consistent high performance while still retaining current optimization algorithms.

顶级标签: systems machine learning model training
详细标签: bayesian optimization scientific instruments high-dimensional optimization domain knowledge coordinate transformation 或 搜索:

领域知识引导的贝叶斯优化用于复杂科学仪器的自主对准 / Domain Knowledge Guided Bayesian Optimization For Autonomous Alignment Of Complex Scientific Instruments


1️⃣ 一句话总结

这篇论文提出了一种新方法,通过利用物理知识对复杂仪器的参数进行坐标变换,将原本困难的高维优化问题变得简单,从而让智能优化算法能够快速、可靠地找到最佳设置。

源自 arXiv: 2602.10670