Examples¶
These notebooks show molforge as it's actually used — multi-step pipelines tying several subpackages together. Each one is self-contained and runnable end-to-end (pre-baked outputs are included so you can read them without re-running).
| Notebook | What it shows |
|---|---|
| Cross-engine validation | Fold the same sequence with ESMFold and AlphaFold, then validate with consensus rules from molforge.validation. |
| De novo design | RFdiffusion → ProteinMPNN → ESMFold pipeline: scaffold, sequence-design, fold-check, filter. |
| End-to-end design | Long-form example: from a binding-site spec to a ranked set of designs ready for wet-lab follow-up. |
Looking for a guided tour of one subpackage at a time? See the walkthroughs instead — six shorter notebooks, one per subpackage.
The raw notebook files live in notebooks/examples/ on GitHub.