Towards Spatially-Lucid AI Classification in Non-Euclidean Space: An Application for MxIF Oncology Data

Given multi-category point sets from different place-types, our goal is to develop a spatially-lucid classifier that can distinguish between two classes based on the arrangements of their points. This problem is important for many applications, such as oncology, for analyzing immune-tumor relationships and designing new immunotherapies. It is challenging due to spatial variability and interpretability needs. Previously proposed techniques require dense training data or have limited ability to handle significant spatial variability within a single place-type. Most importantly, these deep neural network (DNN) approaches are not designed to work in non-Euclidean space, particularly point sets. Existing non-Euclidean DNN methods are limited to one-size-fits-all approaches. We explore a spatial ensemble framework that explicitly uses different training strategies, including weighted-distance learning rate and spatial domain adaptation, on various place-types for spatially-lucid classification. Experimental results on real-world datasets (e.g., MxIF oncology data) show that the proposed framework provides higher prediction accuracy than baseline methods.

Eco-PiNN: A Physics-informed Neural Network for Eco-toll Estimation

The eco-toll estimation problem quantifies the expected environmental cost (e.g., energy consumption, exhaust emissions) for a vehicle to travel along a path. This problem is important for societal applications such as eco-routing, which aims to find paths with the lowest exhaust emissions or energy need. The challenges of this problem are three-fold: (1) the dependence of a vehicle's eco-toll on its physical parameters; (2) the lack of access to data with eco-toll information; and (3) the influence of contextual information (i.e. the connections of adjacent segments in the path) on the eco-toll of road segments. Prior work on eco-toll estimation has mostly relied on pure data-driven approaches and has high estimation errors given the limited training data. To address these limitations, we propose a novel Eco-toll estimation Physics-informed Neural Network framework (Eco-PiNN) using three novel ideas, namely, (1) a physics-informed decoder that integrates the physical laws of the vehicle engine into the network, (2) an attention-based contextual information encoder, and (3) a physics-informed regularization to reduce overfitting. Experiments on real-world heavy-duty truck data show that the proposed method can greatly improve the accuracy of eco-toll estimation compared with state-of-the-art methods.

MC-DGCNN: A Novel DNN Architecture for Multi-Category Point Set Classification

Point set classification aims to build a representation learning model that distinguishes between spatial and categorical configurations of point set data. This problem is societally important since in many applications domains such as immunology, and microbial ecology. This problem is challenging since the interactions between different categories of points are not always equal; as a result, the representation learning model must selectively learn the most relevant multi-categorical relationships. The related works are limited (1) in learning the importance of different multi-categorical relationships, especially for high-order interactions, and (2) do not fully exploit the spatial distribution of points beyond simply measuring relative distance or applying a feed-forward neural network to coordinates. To overcome these limitations, we leverage the dynamic graph convolutional neural network (DGCNN) architecture to design a novel multi-category DGCNN (MC-DGCNN), contributing location representation and point pair attention layers for multi-categorical point set classification. MC-DGCNN has the ability to identify the categorical importance of each point pair and extends this to N-way spatial relationships, while still preserving all the properties and benefits of DGCNN (e.g., differentiability). Experimental results show that the proposed architecture is computationally efficient and significantly outperforms current deep learning architectures on real-world datasets.