3 citations · 4 across the 2 of their papers we have counts for
2 papers
q-bio.BM2020★ 1 cited
InteractionNet: Modeling and Explaining of Noncovalent Protein-Ligand Interactions with Noncovalent Graph Neural Network and Layer-Wise Relevance Propagation
Hyeoncheol Cho, Eok Kyun Lee, Insung S. Choi
Expanding the scope of graph-based, deep-learning models to noncovalent protein-ligand interactions has earned increasing attention in structure-based drug design. Modeling the pro…
cs.LG2018
Three-Dimensionally Embedded Graph Convolutional Network (3DGCN) for Molecule Interpretation
Hyeoncheol Cho, Insung S. Choi
We present a three-dimensional graph convolutional network (3DGCN), which predicts molecular properties and biochemical activities, based on 3D molecular graph. In the 3DGCN, graph…