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Releases: matchms/chemap

0.3.5

02 Mar 17:01

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  • remove regex SMILES check (was too strict)

0.3.4

26 Feb 08:19
68497e5

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  • minor updates to plotting functions (legend setting)
  • minor linting and fixes

0.3.2

17 Feb 20:49

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  • fix bug with umap computations
  • some code cleaning

Full Changelog: 0.3.1...0.3.2

0.3.1

16 Feb 15:32

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What's Changed

Full Changelog: 0.3.0...0.3.1

0.3.0

13 Feb 15:35

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What's Changed

Full Changelog: 0.2.1...0.3.0

0.2.1

02 Feb 14:56

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chemap 0.2.1

  • more unit tests
  • minor function refactoring

Full Changelog: 0.2.0...0.2.1

0.2.0

24 Jan 22:21

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chemap 0.2.0

  • Second refactored basic version
  • Added fingerprint computation parallelization
  • added score refactoring
  • added fingerprint conversions to csr and tfidf as well as folded after tfidf