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Releases: MatrixLabTools/PotentialFitting.jl

v0.3.2

15 Nov 05:42
d272d93
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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

28 Sep 06:22
50ae9cd
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What's Changed

Full Changelog: v0.3.0...v0.3.1

v0.3.0

08 Sep 22:26
e472010
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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

26 Mar 14:44
5593b5d
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This is a bug fix release.

  • GeneralAngle potential calculation fixed
  • Added support for Reexport v1.0

v0.2.2

03 Mar 17:51
6760fa4
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This version has only change to use github actions ci.

No functionality was changed or added.

v0.2.1

02 Mar 19:20
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This version has updates to visualization.

v0.2.0

29 Jan 16:26
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This version has mainly behind the scenes updates that should make everything work better.

v0.1.0

13 Sep 01:15
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initial release