models.md
January 9, 2026 ยท View on GitHub
This is the complete list of FlashMD we make available through this library.
| Name | Available timesteps (fs) | Description |
|---|---|---|
pet-omatpes-v2 | 1, 2, 4, 8, 16, 32, 64, 128 | New version of the pet-omatpes models, more robust at high temperatures |
pet-omatpes | 1, 2, 4, 8, 16, 32, 64, 128 | Trained on the MATPES-r2SCAN dataset |