Additive-feature-attribution methods: a review on explainable artificial intelligence for fluid dynamics and heat transfer

The use of data-driven methods in fluid mechanics has surged dramatically in recent years due to their capacity to adapt to the complex and multi-scale nature of turbulent flows, as well as to detect patterns in large-scale simulations or experimental tests. In order to interpret the relationships generated in the models during the training process, numerical attributions need to be assigned to the input features. One important example are the additive-feature-attribution methods. These explainability methods link the input features with the model prediction, providing an interpretation based on a linear formulation of the models. The SHapley Additive exPlanations (SHAP values) are formulated as the only possible interpretation that offers a unique solution for understanding the model. In this manuscript, the additive-feature-attribution methods are presented, showing four common implementations in the literature: kernel SHAP, tree SHAP, gradient SHAP, and deep SHAP. Then, the main applications of the additive-feature-attribution methods are introduced, dividing them into three main groups: turbulence modeling, fluid-mechanics fundamentals, and applied problems in fluid dynamics and heat transfer. This review shows thatexplainability techniques, and in particular additive-feature-attribution methods, are crucial for implementing interpretable and physics-compliant deep-learning models in the fluid-mechanics field.

Explaining wall-bounded turbulence through deep learning

Despite its great scientific and technological importance, wall-bounded turbulence is an unresolved problem that requires new perspectives to be tackled. One of the key strategies has been to study interactions among the coherent structures in the flow. Such interactions are explored in this study for the first time using an explainable deep-learning method. The instantaneous velocity field in a turbulent channel is used to predict the velocity field in time through a convolutional neural network. The predicted flow is used to assess the importance of each structure for this prediction using a game-theoretic algorithm (SHapley Additive exPlanations). This work provides results in agreement with previous observations in the literature and extends them by quantifying the importance of the Reynolds-stress structures, finding a causal connection between these structures and the dynamics of the flow. The process, based on deep-learning explainability, has the potential to shed light on numerous fundamental phenomena of wall-bounded turbulence, including the objective definition of new types of flow structures.

Aim in Climate Change and City Pollution

The sustainability of urban environments is an increasingly relevant problem. Air pollution plays a key role in the degradation of the environment as well as the health of the citizens exposed to it. In this chapter we provide a review of the methods available to model air pollution, focusing on the application of machine-learning methods. In fact, machine-learning methods have proved to importantly increase the accuracy of traditional air-pollution approaches while limiting the development cost of the models. Machine-learning tools have opened new approaches to study air pollution, such as flow-dynamics modelling or remote-sensing methodologies.

Towards extraction of orthogonal and parsimonious non-linear modes from turbulent flows

We propose a deep probabilistic-neural-network architecture for learning a minimal and near-orthogonal set of non-linear modes from high-fidelity turbulent-flow-field data useful for flow analysis, reduced-order modeling, and flow control. Our approach is based on $\beta$-variational autoencoders ($\beta$-VAEs) and convolutional neural networks (CNNs), which allow us to extract non-linear modes from multi-scale turbulent flows while encouraging the learning of independent latent variables and penalizing the size of the latent vector. Moreover, we introduce an algorithm for ordering VAE-based modes with respect to their contribution to the reconstruction. We apply this method for non-linear mode decomposition of the turbulent flow through a simplified urban environment, where the flow-field data is obtained based on well-resolved large-eddy simulations (LESs). We demonstrate that by constraining the shape of the latent space, it is possible to motivate the orthogonality and extract a set of parsimonious modes sufficient for high-quality reconstruction. Our results show the excellent performance of the method in the reconstruction against linear-theory-based decompositions. Moreover, we compare our method with available AE-based models. We show the ability of our approach in the extraction of near-orthogonal modes that may lead to interpretability.