| Multi-channel learning for integrating structural hierarchies into context-dependent molecular representation | Nov 5, 2023 | Drug DiscoveryMolecular Property Prediction | CodeCode Available | 1 |
| UniMAP: Universal SMILES-Graph Representation Learning | Oct 22, 2023 | Graph MatchingGraph Representation Learning | CodeCode Available | 1 |
| Learning Over Molecular Conformer Ensembles: Datasets and Benchmarks | Sep 29, 2023 | Drug DiscoveryEnsemble Learning | CodeCode Available | 1 |
| Uncovering Neural Scaling Laws in Molecular Representation Learning | Sep 15, 2023 | molecular representationRepresentation Learning | CodeCode Available | 1 |
| GIT-Mol: A Multi-modal Large Language Model for Molecular Science with Graph, Image, and Text | Aug 14, 2023 | Drug DiscoveryImage Captioning | CodeCode Available | 1 |
| Fractional Denoising for 3D Molecular Pre-training | Jul 20, 2023 | DenoisingDrug Discovery | CodeCode Available | 1 |
| Comprehensive evaluation of deep and graph learning on drug-drug interactions prediction | Jun 8, 2023 | Drug DiscoveryGraph Learning | CodeCode Available | 1 |
| Molecule-Morphology Contrastive Pretraining for Transferable Molecular Representation | Apr 27, 2023 | Molecular Property Predictionmolecular representation | CodeCode Available | 1 |
| SELFormer: Molecular Representation Learning via SELFIES Language Models | Apr 10, 2023 | Dimensionality ReductionDrug Discovery | CodeCode Available | 1 |
| InstructBio: A Large-scale Semi-supervised Learning Paradigm for Biochemical Problems | Apr 8, 2023 | molecular representationRepresentation Learning | CodeCode Available | 1 |
