LITE: Efficiently Estimating Gaussian Probability of Maximality

Fuente: arXiv
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Autori principali: Menet, Nicolas, Hübotter, Jonas, Kassraie, Parnian, Krause, Andreas
Natura: Preprint
Pubblicazione: 2025
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author Menet, Nicolas
Hübotter, Jonas
Kassraie, Parnian
Krause, Andreas
author_facet Menet, Nicolas
Hübotter, Jonas
Kassraie, Parnian
Krause, Andreas
contents We consider the problem of computing the probability of maximality (PoM) of a Gaussian random vector, i.e., the probability for each dimension to be maximal. This is a key challenge in applications ranging from Bayesian optimization to reinforcement learning, where the PoM not only helps with finding an optimal action, but yields a fine-grained analysis of the action domain, crucial in tasks such as drug discovery. Existing techniques are costly, scaling polynomially in computation and memory with the vector size. We introduce LITE, the first approach for estimating Gaussian PoM with almost-linear time and memory complexity. LITE achieves SOTA accuracy on a number of tasks, while being in practice several orders of magnitude faster than the baselines. This also translates to a better performance on downstream tasks such as entropy estimation and optimal control of bandits. Theoretically, we cast LITE as entropy-regularized UCB and connect it to prior PoM estimators.
format Preprint
id arxiv_https___arxiv_org_abs_2501_13535
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle LITE: Efficiently Estimating Gaussian Probability of Maximality
Menet, Nicolas
Hübotter, Jonas
Kassraie, Parnian
Krause, Andreas
Machine Learning
Computation
Methodology
We consider the problem of computing the probability of maximality (PoM) of a Gaussian random vector, i.e., the probability for each dimension to be maximal. This is a key challenge in applications ranging from Bayesian optimization to reinforcement learning, where the PoM not only helps with finding an optimal action, but yields a fine-grained analysis of the action domain, crucial in tasks such as drug discovery. Existing techniques are costly, scaling polynomially in computation and memory with the vector size. We introduce LITE, the first approach for estimating Gaussian PoM with almost-linear time and memory complexity. LITE achieves SOTA accuracy on a number of tasks, while being in practice several orders of magnitude faster than the baselines. This also translates to a better performance on downstream tasks such as entropy estimation and optimal control of bandits. Theoretically, we cast LITE as entropy-regularized UCB and connect it to prior PoM estimators.
title LITE: Efficiently Estimating Gaussian Probability of Maximality
topic Machine Learning
Computation
Methodology
url https://arxiv.org/abs/2501.13535