 Kernel-Elastic Autoencoder for Molecular DesignPNAS Nexus (PNAS Nexus), 2023 |
 SANGEA: Scalable and Attributed Network GenerationAsian Conference on Machine Learning (ACML), 2023 |
 Hierarchical Grammar-Induced Geometry for Data-Efficient Molecular
Property PredictionInternational Conference on Machine Learning (ICML), 2023 |
 DOCKSTRING: easy molecular docking yields better benchmarks for ligand
designJournal of Chemical Information and Modeling (JCIM), 2021 |
 Learning to Extend Molecular Scaffolds with Structural MotifsInternational Conference on Learning Representations (ICLR), 2021 |
 Deep Graph Generators: A SurveyIEEE Access (IEEE Access), 2020 |
