Feeley Ryan, Frenklach Michael, Onsum Matt, Russi Trent, Arkin Adam, Packard Andrew
Department of Mechanical Engineering, University of California, Berkeley, California 94720-1740, USA.
J Phys Chem A. 2006 Jun 1;110(21):6803-13. doi: 10.1021/jp056309s.
This paper introduces a practical data-driven method to discriminate among large-scale kinetic reaction models. The approach centers around a computable measure of model/data mismatch. We introduce two provably convergent algorithms that were developed to accommodate large ranges of uncertainty in the model parameters. The algorithms are demonstrated on a simple toy example and a methane combustion model with more than 100 uncertain parameters. They are subsequently used to discriminate between two models for a contemporarily studied biological signaling network.
本文介绍了一种实用的数据驱动方法,用于区分大规模动力学反应模型。该方法围绕模型/数据不匹配的可计算度量展开。我们引入了两种经证明收敛的算法,这些算法是为适应模型参数的大范围不确定性而开发的。这些算法在一个简单的示例和一个具有100多个不确定参数的甲烷燃烧模型上得到了验证。随后,它们被用于区分一个当代研究的生物信号网络的两个模型。