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A Discrete Diffusion Model for de novo Molecular Generation with Continuous Property GuidancePartha SuryanarayananShreyans Sethiet al.2025ACS Fall 2025
Towards accelerating small molecule drug discovery with pre-trained, late fusion multi-view modelsJoseph MorroneDiwakar Mahajanet al.2024ACS Fall 2024
Multimodal Molecular Representation Learning for Small Molecule Drug Discovery - Pretraining and Early Fusion ArchitecturesPartha SuryanarayananShreyans Sethiet al.2024ACS Fall 2024
SPARK: Harnessing Human-Centered Workflows with Biomedical Foundation Models for Drug DiscoveryBc KwonSimona Rabinovici-Cohenet al.2024IJCAI 2024