Conditional 2D Molecular Graph Generation on Synth. & BBBP
92.73DiversityMOOD
Evaluation results
| Method | Links | |||||
|---|---|---|---|---|---|---|
| MOODParadigm=Diffusion2025.10 | 92.73 | 17.15 | 2.028 | 49.03 | 9.8 | |
| TreeDiffParadigm=Inference-Time2025.10 | 91.62 | 93.63 | 0.342 | 94.81 | 1.9 | |
| DiGress v2Paradigm=Diffusion2025.10 | 91.07 | 63.36 | 2.269 | 65.31 | 9.2 | |
| DiGressParadigm=Diffusion2025.10 | 90.98 | 68.05 | 2.366 | 65.36 | 9.1 | |
| TAGMolParadigm=Inference-Time2025.10 | 90.45 | 91.43 | 0.372 | 94.46 | 4.5 | |
| Graph-GAParadigm=Tradition2025.10 | 89.5 | 95.09 | 1.208 | 30.15 | 7.3 | |
| Best-of-NParadigm=Inference-Time2025.10 | 89.29 | 92.41 | 0.42 | 93.8 | 5.8 | |
| LSTM-HCParadigm=Tradition2025.10 | 88.83 | 89.32 | 0.997 | 55.9 | 7.8 | |
| SVDDParadigm=Inference-Time2025.10 | 88.81 | 92.69 | 0.46 | 93.5 | 6.3 | |
| Graph DiTParadigm=Diffusion2025.10 | 88.56 | 93.29 | 0.355 | 94.17 | 4.8 | |
| Beam SearchParadigm=Inference-Time2025.10 | 88.53 | 92.86 | 0.405 | 94.11 | 5.3 | |
| MARSParadigm=Tradition2025.10 | 86.37 | 76.96 | 1.225 | 51.89 | 9.5 | |
| GDSSParadigm=Diffusion2025.10 | 84.15 | 26.72 | 1.379 | 50.37 | 11.9 | |
| JTVAE-BOParadigm=Tradition2025.10 | 74.58 | 58.21 | 1.162 | 49.58 | 11.8 |