diff --git a/CHANGELOG.md b/CHANGELOG.md index 99c5112c..c0ba6130 100644 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -1,6 +1,21 @@ # Changelog +## [6.12.0](https://github.com/graeter-group/kimmdy/compare/v6.11.0...v6.12.0) (2024-09-16) + + +### Features + +* expose create_plumed_input ([#483](https://github.com/graeter-group/kimmdy/issues/483)) ([505c823](https://github.com/graeter-group/kimmdy/commit/505c823afdd523f3c7170be270f06c8aa1fc18bf)) + + +### Bug Fixes + +* copy gro to setup ([#487](https://github.com/graeter-group/kimmdy/issues/487)) ([25ac265](https://github.com/graeter-group/kimmdy/commit/25ac2650800c6a07b051b815b4b1b60308cc498e)) +* link residuetypedat ([#488](https://github.com/graeter-group/kimmdy/issues/488)) ([2576440](https://github.com/graeter-group/kimmdy/commit/2576440e3360f6a87257019eda56385c075ccafd)) +* truncate time in plumed output to 1 fs ([#484](https://github.com/graeter-group/kimmdy/issues/484)) ([b73104a](https://github.com/graeter-group/kimmdy/commit/b73104a5e81974c7864703fa5e2162f6b7d4575d)) +* use correct distances.dat when starting from existing traj ([#485](https://github.com/graeter-group/kimmdy/issues/485)) ([d0c9859](https://github.com/graeter-group/kimmdy/commit/d0c985967fbd9d879ae2f0c813788a91c9492779)) + ## [6.11.0](https://github.com/graeter-group/kimmdy/compare/v6.10.3...v6.11.0) (2024-09-04) diff --git a/setup.cfg b/setup.cfg index bcc28a5d..71fbcba3 100644 --- a/setup.cfg +++ b/setup.cfg @@ -1,6 +1,6 @@ [metadata] name = kimmdy -version = 6.11.0 +version = 6.12.0 license = MIT description = Kinetic Monte Carlo Molecular Dynamics description_content_type = text/markdown