Conditional 3D Molecule Generation on QM9 (Physical Properties)
1.616Dipole Moment µ (D)Random
Evaluation results
| Method | Links | ||||||
|---|---|---|---|---|---|---|---|
| Random2026.06 | 1.616 | 9.01 | 6.857 | 645 | 1,457 | 1,470 | |
| U-Bound2025.12 | 1.613 | 8.98 | 6.879 | 645 | 1,457 | 1,464 | |
| EDM2025.12 | 1.123 | 2.78 | 1.065 | 371 | 601 | 671 | |
| EDM2026.06 | 1.111 | 2.76 | 1.101 | 356 | 584 | 655 | |
| GeoLDM2025.12 | 1.108 | 2.37 | 1.025 | 340 | 522 | 587 | |
| GeoLDM2026.06 | 1.108 | 2.37 | 1.025 | 340 | 522 | 587 | |
| GeoBFN2025.12 | 0.998 | 2.34 | 0.949 | 328 | 516 | 577 | |
| RADM2026.06 | 0.814 | 1.98 | 0.869 | 290 | 383 | 458 | |
| EEGSDE2025.12 | 0.777 | 2.5 | 0.941 | 302 | 447 | 487 | |
| RADM+UCDbase_model=RADM2026.06 | 0.773 | 1.94 | 0.862 | 280 | 368 | 439 | |
| JODO2025.12 | 0.628 | 1.42 | 0.581 | 226 | 256 | 335 | |
| UDM-3D2025.12 | 0.603 | 1.54 | 0.553 | 216 | 247 | 313 | |
| NExT-Mol2025.12 | 0.507 | 1.16 | 0.512 | 205 | 235 | 297 | |
| MolSculpt2025.12 | 0.338 | 0.29 | 0.131 | 63 | 62 | 85 | |
| L-Bound2025.12 | 0.043 | 0.09 | 0.04 | 39 | 36 | 65 | |
| QM9note=Lower bound2026.06 | 0.043 | 0.1 | 0.04 | 39 | 36 | 64 |