MolNet: A Chemically Intuitive Graph Neural Network for Prediction of Molecular Properties

1 code implementation • 1 Feb 2022 • YeJi Kim, Yoonho Jeong, Jihoo Kim, Eok Kyun Lee, Won June Kim, Insung S. Choi

The graph neural network (GNN) has been a powerful deep-learning tool in chemistry domain, due to its close connection with molecular graphs.

Graph Neural Network