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HybridML: Open source platform for hybrid modeling.

Authors :
Merkelbach, Kilian
Schweidtmann, Artur M.
Müller, Younes
Schwoebel, Patrick
Mhamdi, Adel
Mitsos, Alexander
Schuppert, Andreas
Mrziglod, Thomas
Schneckener, Sebastian
Source :
Computers & Chemical Engineering. Apr2022, Vol. 160, pN.PAG-N.PAG. 1p.
Publication Year :
2022

Abstract

• Introduce HybridML, an open source hybrid modeling platform. • Train hybrid models including neural networks and differential equations in Tensorflow. • Build a hybrid model to predict the drug concentration in patients' blood over time. Hybrid modelling, i.e., the combination of data-driven modelling with mechanistic model components, reduces the data demand and enables extrapolation of data-driven models. However, building, training and evaluation of hybrid models is cumbersome with current frameworks. We developed HybridML, an open-source modeling platform, in which hybrid models can be trained, i.e., combinations of artificial neural networks, arithmetic expressions, and differential equations. We employ TensorFlow for artificial neural network training and Casadi to integrate ordinary differential equations and provide gradients of differential model equations enabling continuous time representations. HybridML provides also a JSON interface for the model development. We apply HybridML to an industrial case study, in which the trained model is used to predict drug concentrations over time, based on physiological information about the patients. To demonstrate its versatility, we also present a nonlinear application, where HybridML is used to model the spread of the COVID-19 pandemic in German federal states based on the state's socio-economic attributes. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00981354
Volume :
160
Database :
Academic Search Index
Journal :
Computers & Chemical Engineering
Publication Type :
Academic Journal
Accession number :
155696831
Full Text :
https://doi.org/10.1016/j.compchemeng.2022.107736