| Graph Energy-based Model for Molecular Graph Generation | Feb 26, 2021 | Graph Generationmodel | —Unverified | 0 |
| GraphNVP: an Invertible Flow-based Model for Generating Molecular Graphs | Sep 25, 2019 | Graph GenerationMolecular Graph Generation | —Unverified | 0 |
| Graph Residual Flow for Molecular Graph Generation | Sep 30, 2019 | Graph GenerationMolecular Graph Generation | —Unverified | 0 |
| GUISE: Graph GaUssIan Shading watErmark | Oct 14, 2024 | Graph GenerationMolecular Graph Generation | —Unverified | 0 |
| Improving Molecular Graph Generation with Flow Matching and Optimal Transport | Nov 8, 2024 | Drug DesignGraph Generation | —Unverified | 0 |
| Interpretable Molecular Graph Generation via Monotonic Constraints | Feb 28, 2022 | DisentanglementDrug Discovery | —Unverified | 0 |
| Learning-Order Autoregressive Models with Application to Molecular Graph Generation | Mar 7, 2025 | Graph GenerationMolecular Graph Generation | —Unverified | 0 |
| Lift Your Molecules: Molecular Graph Generation in Latent Euclidean Space | Jun 15, 2024 | Edge ClassificationGraph Generation | —Unverified | 0 |
| Molecular Graph Generation by Decomposition and Reassembling | Dec 11, 2022 | Drug DiscoveryGraph Generation | —Unverified | 0 |
| Molecular Graph Generation via Geometric Scattering | Oct 12, 2021 | Drug DesignGraph Generation | —Unverified | 0 |
| Molecular graph generation with Graph Neural Networks | Dec 14, 2020 | Drug DiscoveryGraph Generation | —Unverified | 0 |
| Molecular Inverse-Design Platform for Material Industries | Apr 24, 2020 | Graph GenerationMolecular Graph Generation | —Unverified | 0 |
| Overcoming Order in Autoregressive Graph Generation | Feb 4, 2024 | Graph GenerationMolecular Graph Generation | —Unverified | 0 |
| Pretraining Generative Flow Networks with Inexpensive Rewards for Molecular Graph Generation | Mar 8, 2025 | Drug DesignGraph Generation | —Unverified | 0 |
| Realistic molecule optimization on a learned graph manifold | Jun 3, 2021 | Drug DesignGraph Generation | —Unverified | 0 |
| Spanning Tree-based Graph Generation for Molecules | Sep 29, 2021 | Graph GenerationMolecular Graph Generation | —Unverified | 0 |
| Target-aware Molecular Graph Generation | Feb 10, 2022 | Drug DiscoveryGraph Generation | —Unverified | 0 |
| Training-Free Guidance for Discrete Diffusion Models for Molecular Generation | Sep 11, 2024 | Graph GenerationMolecular Graph Generation | —Unverified | 0 |
| GraphEBM: Molecular Graph Generation with Energy-Based Models | Jan 31, 2021 | Graph GenerationMolecular Graph Generation | CodeCode Available | 0 |
| MARS: Markov Molecular Sampling for Multi-objective Drug Discovery | Mar 18, 2021 | Drug DiscoveryGraph Neural Network | CodeCode Available | 0 |
| Graph Convolutional Policy Network for Goal-Directed Molecular Graph Generation | Jun 7, 2018 | Graph GenerationMolecular Graph Generation | CodeCode Available | 0 |
| GraphNVP: An Invertible Flow Model for Generating Molecular Graphs | May 28, 2019 | Graph GenerationMolecular Graph Generation | CodeCode Available | 0 |
| Reinforced Molecular Optimization with Neighborhood-Controlled Grammars | Nov 14, 2020 | Graph GenerationMolecular Graph Generation | CodeCode Available | 0 |
| GraphSPNs: Sum-Product Networks Benefit From Canonical Orderings | Aug 18, 2024 | Molecular Graph Generationvalid | CodeCode Available | 0 |
| MolecularRNN: Generating realistic molecular graphs with optimized properties | May 31, 2019 | Drug DiscoveryMolecular Graph Generation | CodeCode Available | 0 |