Releases: MatrixLabTools/PotentialFitting.jl
Releases · MatrixLabTools/PotentialFitting.jl
v0.3.2
What's Changed
- CompatHelper: add new compat entry for Statistics at version 1, (keep existing compat) by @github-actions in #42
- CompatHelper: bump compat for MLJ to 0.20, (keep existing compat) by @github-actions in #41
- Fix exports by @tjjarvinen in #43
Full Changelog: v0.3.1...v0.3.2
v0.3.1
What's Changed
- ACE extension by @tjjarvinen in #38
- Remove nightly from CI by @tjjarvinen in #39
- Small name change to solver by @tjjarvinen in #40
Full Changelog: v0.3.0...v0.3.1
v0.3.0
Main New Features
- Use Makie to draw figures
- Use MLJ instead of SKLearn
- AtomsBase support
What's Changed
- Add support for v0.4.0 PotentialCalculation by @tjjarvinen in #18
- Use Makie for visualizations by @tjjarvinen in #19
- AtomsBase support by @tjjarvinen in #20
- Small Documentation Fix by @tjjarvinen in #21
- CompatHelper: bump compat for StatsBase to 0.34, (keep existing compat) by @github-actions in #22
- CompatHelper: bump compat for ScikitLearn to 0.7, (keep existing compat) by @github-actions in #23
- CompatHelper: add new compat entry for Unitful at version 1, (keep existing compat) by @github-actions in #26
- Clean code and fix small things by @tjjarvinen in #27
- CompatHelper: add new compat entry for UnitfulAtomic at version 1, (keep existing compat) by @github-actions in #25
- Update PotentialCalculation version by @tjjarvinen in #28
- Update fitting method by @tjjarvinen in #29
- Update figures by @tjjarvinen in #30
- Update doc build by @tjjarvinen in #33
- CompatHelper: add new compat entry for MLJGLMInterface at version 0.3, (keep existing compat) by @github-actions in #32
- CompatHelper: add new compat entry for MLJ at version 0.19, (keep existing compat) by @github-actions in #31
- Add support for more MLJ solvers by @tjjarvinen in #34
- Small fixes by @tjjarvinen in #35
- Functionality to generate initial structures for MD by @tjjarvinen in #36
Full Changelog: v0.2.3...v0.3.0
v0.2.3
This is a bug fix release.
- GeneralAngle potential calculation fixed
- Added support for Reexport v1.0
v0.2.2
This version has only change to use github actions ci.
No functionality was changed or added.
v0.2.1
This version has updates to visualization.
v0.2.0
This version has mainly behind the scenes updates that should make everything work better.
v0.1.0
initial release