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Releases: JensKrumsieck/ChemSharp

2.1.1

19 Feb 18:11
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What's Changed

  • Add PDB Exporter
  • Bump Microsoft.AspNetCore.ClientAssets from 0.1.0-alpha.21528.2 to 0.1.0-alpha.23330.1 by @dependabot in #101

Full Changelog: v.2.1.0...v2.1.1

2.1.0

31 Jul 08:29
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Refactored out System.Text.Json from ElementDataProvider.cs using SourceGeneration 1a27287

Full Changelog: v2.0.1...v.2.1.0

v2.0.1

20 Jun 21:39
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[Helix Toolkit] Added Static Field for Selected Atom Color

Full Changelog: v2.0.0...v2.0.1

2.0.0

01 Mar 15:17
7a49ffe
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What's Changed

Breaking Changes:

  • Added the new Formats for Structural Files!
  • DataProviders removed
  • Use Molecule.FromX instead of MoleculeFactory
  • Use Spectrum.FromFile instead of SpectrumFactory

Changes

  • Molecules are UndirectedGraphs now!
  • new Format: mmCIF
  • new Format: PDB Ligand CIF
  • Performance Improvements (up to 10x faster)
  • More Codegenerators
  • Use XUnit for tests

Full Changelog: v1.0.15...v2.0.0

2.0.0 beta 1

01 Dec 15:43
6e54f0d
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2.0.0 beta 1 Pre-release
Pre-release

What's Changed

Full Changelog: v1.0.15...v2.0.0-beta.1

2.0.0 Alpha 3

13 Sep 11:30
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2.0.0 Alpha 3 Pre-release
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v2.0.0-alpha.2

05 Sep 21:14
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v2.0.0-alpha.2 Pre-release
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2.0.0 Alpha 1

02 Sep 19:24
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2.0.0 Alpha 1 Pre-release
Pre-release

Decided to go with 2.0.x instead of 1.1.x

1.1.0 Beta 2

26 Jul 11:38
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1.1.0 Beta 2 Pre-release
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v1.1.0-beta.2

Beta2

1.1.0 Beta 1

16 May 13:19
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1.1.0 Beta 1 Pre-release
Pre-release

THIS IS A NON-STABLE PRE-RELEASE! Use 1.0.x in production!

Breaking Changes:

  • Added the new Formats for Structural Files!
  • DataProviders are obsolete for Structural Files!
  • Use Molecule.FromX instead of MoleculeFactory

Changes

  • Molecules are UndirectedGraphs now!
  • new Format: mmCIF
  • new Format: PDB Ligand CIF
  • Performance Improvements (up to 10x faster)
  • More Codegenerators
  • Use XUnit for tests

Full Changelog: v1.0.15...v1.1.0-beta.1