Summary

Download and compare the Rh-enamide transition state force field from the QFUERZA Zenodo archive against our optimized Rh-enamide results.

Context

The Zenodo archive (10.5281/zenodo.17386006) contains the full Rh-enamide force field files (~1.8 GB, includes QM data). This is a more complex validation than cisplatin because Rh-enamide is a transition state with many more parameters, and it's the system we actually benchmark on.

Comparing our optimized Rh-enamide TSFF against the paper's published version would be the strongest possible validation of our full pipeline (Seminario + QFUERZA + optimization).

Acceptance criteria

• Download Rh-enamide .fld files from Zenodo
• Extract force constants from the paper's QFUERZA-optimized FF
• Compare against our optimized Rh-enamide FF
• Document parameter-by-parameter comparison
• Identify and explain any discrepancies (expected due to different optimizer implementations)

References

• docs/benchmarks/qfuerza-validation.md section 5
• benchmarks/rh-enamide/