0.4.0 (2025-08-11)
- pyproject.toml (5f931e0)
- ci: release permisisons (cfbe38d)
- conflicting license information (#25) (8f275dd)
- don't directly depend on grappa-ff (f95e19b)
- pyproject file (d8f3232)
0.3.2 (2025-03-06)
- trigger release to build docs on release PR (9508586)
0.3.1 (2025-03-06)
0.3.0 (2024-09-06)
- give kimmdy_grappa its own module (4ab0a14)
0.2.0 (2024-02-26)
- make grappa v.1.1 compatible (tested) (3b545f6)
- Merge pull request #14 from hits-mbm-dev/grappa1.1_compatible (3b545f6)
0.1.5 (2024-02-12)
- don't dump mol into log (b98aa9e)
0.1.4 (2024-01-31)
- fail for molecule without a certain type of parameters (27de85d)
0.1.3 (2023-11-07)
- make release use patch version number (ad90027)
0.1.2 (2023-11-07)
- trigger release (2b9b894)
0.1.1 (2023-11-07)
- description content type (9cf3f6b)
- trigger release (25f9aad)