Graph Convolutional Neural Networks with Global Attention for Improved Materials Property Prediction

Phys. Chem. Chem. Phys., 2020, Accepted Manuscript DOI: 10.1039/D0CP01474E, PaperSteph-Yves M Louis, Yong Zhao, Alirezaq Nasiri, Xiran Wang, Yuqi Song, Fei Liu, Jianjun Hu One of the major design issues in machine learning (ML) models for materials property prediction(MPP) is how to enable the models to learn property related physicochemical features. While many composition... The content of this RSS Feed (c) The Royal Society of Chemistry
Source: RSC - Phys. Chem. Chem. Phys. latest articles - Category: Chemistry Authors: Source Type: research