论文标题

部分可观测时空混沌系统的无模型预测

Design of Turing Systems with Physics-Informed Neural Networks

论文作者

Kho, Jordon, Koh, Winston, Wong, Jian Cheng, Chiu, Pao-Hsiung, Ooi, Chin Chun

论文摘要

Reaction-diffusion (Turing) systems are fundamental to the formation of spatial patterns in nature and engineering.这些系统受一组非线性偏微分方程的控制,其中包含确定构成扩散率和反应速率的参数。至关重要的是,这些参数,例如扩散系数,严重影响最终模式的模式和类型,以及这些参数的定量表征和知识可以帮助实现生物模拟设计或对现实世界系统的理解。 However, the use of numerical methods to infer these parameters can be difficult and computationally expensive. Typically, adjoint solvers may be used, but they are frequently unstable for very non-linear systems. Alternatively, massive amounts of iterative forward simulations are used to find the best match, but this is extremely effortful.最近,已经提出了物理信息的神经网络,作为数据驱动的部分微分方程的一种手段,并在各种应用程序中都获得了成功。因此,我们研究了物理信息信息的使用作为一种工具,以推断稳态中的反应扩散系统中的关键参数,以进行科学发现或设计。我们的概念验证结果表明,该方法能够针对不同模式和类型的类型推断出误差小于10 \%的参数。此外,可以利用此方法的随机性为所需模式提供多种参数替代方案,从而突出了此方法的多功能性用于生物模拟设计。因此,这项工作证明了物理知识的神经网络对反应扩散系统的反参数推断的实用性,以增强科学发现和设计。

Reaction-diffusion (Turing) systems are fundamental to the formation of spatial patterns in nature and engineering. These systems are governed by a set of non-linear partial differential equations containing parameters that determine the rate of constituent diffusion and reaction. Critically, these parameters, such as diffusion coefficient, heavily influence the mode and type of the final pattern, and quantitative characterization and knowledge of these parameters can aid in bio-mimetic design or understanding of real-world systems. However, the use of numerical methods to infer these parameters can be difficult and computationally expensive. Typically, adjoint solvers may be used, but they are frequently unstable for very non-linear systems. Alternatively, massive amounts of iterative forward simulations are used to find the best match, but this is extremely effortful. Recently, physics-informed neural networks have been proposed as a means for data-driven discovery of partial differential equations, and have seen success in various applications. Thus, we investigate the use of physics-informed neural networks as a tool to infer key parameters in reaction-diffusion systems in the steady-state for scientific discovery or design. Our proof-of-concept results show that the method is able to infer parameters for different pattern modes and types with errors of less than 10\%. In addition, the stochastic nature of this method can be exploited to provide multiple parameter alternatives to the desired pattern, highlighting the versatility of this method for bio-mimetic design. This work thus demonstrates the utility of physics-informed neural networks for inverse parameter inference of reaction-diffusion systems to enhance scientific discovery and design.

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