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Paper · arXiv

Agentic Calibration of Grey-Box Simulation Models: An LLM-Driven Alternative

Calibration of grey-box simulation models is a constrained optimization problem in which model evaluations are expensive, the parameter space can be high-dimensional, and the search must respect plausibility constraints. Although the simulation code is fully available to the analyst, the joint effect of multiple parameters remains difficult to predict analytically. Classical optimizers such as Nelder--Mead (NM) are simple to deploy but sample-inefficient, particularly under constraints. Modern Bayesian Optimization methods achieve competitive solutions with far fewer evaluations but require non-trivial modeling machinery for constraint handling. We introduce an agentic calibration method ...

AuthorsDavid Gómez-Guillén, Mireia Diaz, Josep Lluis Arcos et al.
Primary categorycs.LG
Published17 July 2026
Last updated at source17 July 2026
cs.LGcs.AI
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