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| DecompOpt: Controllable and Decomposed Diffusion Models for Structure-based Molecular Optimization | Mar 7, 2024 | Drug DesignDrug Discovery | —Unverified | 0 |
| Automating reward function configuration for drug design | Dec 15, 2023 | Drug DesignDrug Discovery | —Unverified | 0 |
| Decoding Drug Discovery: Exploring A-to-Z In silico Methods for Beginners | Dec 15, 2024 | Drug DesignDrug Discovery | —Unverified | 0 |
| DCI: An Accurate Quality Assessment Criteria for Protein Complex Structure Models | Jun 30, 2024 | Drug Design | —Unverified | 0 |
| AUTODIFF: Autoregressive Diffusion Modeling for Structure-based Drug Design | Apr 2, 2024 | Drug DesignDrug Discovery | —Unverified | 0 |
| Data-Efficient Protein 3D Geometric Pretraining via Refinement of Diffused Protein Structure Decoy | Feb 5, 2023 | DiversityDrug Design | —Unverified | 0 |
| CTAGE: Curvature-Based Topology-Aware Graph Embedding for Learning Molecular Representations | Jul 25, 2023 | Drug DesignGraph Embedding | —Unverified | 0 |
| A Graph Completion Method that Jointly Predicts Geometry and Topology Enables Effective Molecule Assembly | May 27, 2025 | DenoisingDrug Design | —Unverified | 0 |
| Graph Memory Networks for Molecular Activity Prediction | Jan 8, 2018 | Activity PredictionDrug Design | —Unverified | 0 |
