| Conditional Diffusion Based on Discrete Graph Structures for Molecular Graph Generation | Jan 1, 2023 | Drug DiscoveryGraph Generation | CodeCode Available | 1 | 5 |
| A Simple and Scalable Representation for Graph Generation | Dec 4, 2023 | Graph GenerationMolecular Graph Generation | CodeCode Available | 1 | 5 |
| Sample-Efficient Optimization in the Latent Space of Deep Generative Models via Weighted Retraining | Jun 16, 2020 | Drug DesignMolecular Graph Generation | CodeCode Available | 1 | 5 |
| Target Specific De Novo Design of Drug Candidate Molecules with Graph Transformer-based Generative Adversarial Networks | Feb 15, 2023 | Generative Adversarial NetworkMolecular Graph Generation | CodeCode Available | 1 | 5 |
| 3M-Diffusion: Latent Multi-Modal Diffusion for Language-Guided Molecular Structure Generation | Mar 11, 2024 | DecoderDrug Discovery | CodeCode Available | 1 | 5 |
| Graph Generation with Diffusion Mixture | Feb 7, 2023 | 3D Molecule GenerationGraph Generation | CodeCode Available | 1 | 5 |
| HyFactor: Hydrogen-count labelled graph-based defactorization Autoencoder | Dec 6, 2021 | BenchmarkingGraph Learning | CodeCode Available | 1 | 5 |
| GraphEBM: Molecular Graph Generation with Energy-Based Models | Jan 31, 2021 | Graph GenerationMolecular Graph Generation | CodeCode Available | 0 | 5 |
| MARS: Markov Molecular Sampling for Multi-objective Drug Discovery | Mar 18, 2021 | Drug DiscoveryGraph Neural Network | CodeCode Available | 0 | 5 |
| Graph Convolutional Policy Network for Goal-Directed Molecular Graph Generation | Jun 7, 2018 | Graph GenerationMolecular Graph Generation | CodeCode Available | 0 | 5 |
