 SS-GNN: A Simple-Structured Graph Neural Network for Affinity PredictionACS Omega (ACS Omega), 2022 |
 GeomGCL: Geometric Graph Contrastive Learning for Molecular Property
PredictionAAAI Conference on Artificial Intelligence (AAAI), 2021 |
 Structure-aware Interactive Graph Neural Networks for the Prediction of
Protein-Ligand Binding AffinityKnowledge Discovery and Data Mining (KDD), 2021 |
 High-Throughput Virtual Screening of Small Molecule Inhibitors for
SARS-CoV-2 Protein Targets with Deep Fusion ModelsInternational Conference for High Performance Computing, Networking, Storage and Analysis (SC), 2021 |
