OpenFreeEnergy / openfe

The Open Free Energy toolkit
https://docs.openfree.energy
MIT License
135 stars 18 forks source link

cli: fetch-rbfe-results outdated #778

Closed richardjgowers closed 6 months ago

richardjgowers commented 6 months ago

Looks like these files need updating for the 1.0 release, they currently fail on gather with:

pydantic.error_wrappers.ValidationError: 2 validation errors for OutputSettings
output_filename
  extra fields not permitted (type=value_error.extra)
output_structure
  extra fields not permitted (type=value_error.extra)
richardjgowers commented 6 months ago

fixed in #779