2 papers
math.NA2026
Integral chemical reaction neural networks
Abraham Reyes-Velázquez, Stefan Güttel
Discovering the structure and kinetics of chemical reaction networks (CRNs) from time-series concentration data is a fundamental challenge in chemical kinetics, with existing appro…
math.NA2026
Data-driven discovery of chemical reaction networks
Abraham Reyes-Velazquez, Stefan Güttel, Igor Larrosa +1
We propose a unified framework that allows for the full mechanistic reconstruction of chemical reaction networks (CRNs) from concentration data. The framework utilizes an integral…