Attentive Neural Processes and Batch Bayesian Optimization for Scalable Calibration of Physics-Informed Digital Twins

Physics-informed dynamical system models form critical components of digital twins of the built environment. These digital twins enable the design of energy-efficient infrastructure, but must be properly calibrated to accurately reflect system behavior for downstream prediction and analysis. Dynamical system models of modern buildings are typically described by a large number of parameters and incur significant computational expenditure during simulations. To handle large-scale calibration of digital twins without exorbitant simulations, we propose ANP-BBO: a scalable and parallelizable batch-wise Bayesian optimization (BBO) methodology that leverages attentive neural processes (ANPs).