Paper | Code | Validity | PoseBusters Internal Energy | ModelName | ReleaseDate |
---|---|---|---|---|---|
All-atom Diffusion Transformers: Unified generative modelling of molecules and materials | ✓ Link | 94.45 | 95.86 | ADiT | 2025-03-05 |
Geometric Latent Diffusion Models for 3D Molecule Generation | ✓ Link | 93.80 | GeoLDM | 2023-05-02 | |
Equivariant Diffusion for Molecule Generation in 3D | ✓ Link | 91.90 | 94.88 | EDM | 2022-03-31 |
Symphony: Symmetry-Equivariant Point-Centered Spherical Harmonics for 3D Molecule Generation | ✓ Link | 83.50 | 95.65 | Symphony | 2023-11-27 |