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Releases: pymzml/pymzML

Release 2.5.0

02 Jun 13:49
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  • add ms level 0 with precision of 0.0001 for spectra without MS level (e.g. UV spectra)
  • allow saving plots as pdf
  • fix py38 warning
  • add methods to retrieve ion mobility arrays
  • require at least python 3.7
  • fix centroiding issue due to change in new obo

Upgrade to v2.4.7 release version

17 Jun 09:28
65941b8
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Release v2.4.7

fix bug when calling scan_time_in_minutes serveral time resulting in casting conversion every time
allow user to set a custom regex for parsing the mzML index
update readme with instructions for testing with tox
fix bug which made pymzML crash when ms_level is 0
update sphinx dependency
the reader is now reset to the inital state after iterating all spectra
fix bugs when parsing mzML files with non numerical id

Upgrade to v2.4.2 release version

13 Aug 11:44
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  • optimize spectrum class methods to make better use of numpy
  • add remove_precursor_peak method in spectrum class

Upgrade to v2.4.0 release version

05 Aug 12:43
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  • Implement spectrum deconvolution using ms_deisotope

Release 2.3.1

31 Jul 12:31
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This release provides the latest version for the second generation of pymzML.

Changelog (for details please refer to commit log)

  • use black code style
  • use tox for testing
  • automatically deploy to pypi on tags
  • update to newest plotly version
  • add codecov bot
  • add different badges to README
  • add Contributing and Code of Conduct
  • fix issue when averaging spectra (#147)
  • add pull request template

Release 2.2.5

18 Jul 08:46
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This release provides the latest version for the second generation of pymzML.

Changelog (for details please refer to commit log)

  • add missing obo files
  • Fall back to first obo version of the year if obo version is a date

Release 2.2.1

20 May 15:53
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This release provides the latest version for the second generation of pymzML 2.x.x

Changelog (for details please refer to commit log)

  • Add missing dependency in setup.py

Release 2.2.0

01 Apr 15:57
86cb9d6
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This release provides the latest version for the second generation of pymzML 2.x.x

Changelog (for details please refer to commit log)

  • Merged pull request #126

Release 2.1.0

08 Feb 17:21
be4ff3e
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This release provides the latest version for the second generation of pymzML 2.x.x

Changelog (for details please refer to commit log)

  • merged #113 and #94
  • moved methods from spectrum class to MS_Spectrum

Release v2.0.5

11 Oct 13:22
9ffac58
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This release provides the latest version for the second generation of pymzML 2.x.x

Changelog (for details please refer to commit log)

  • added latest .obo files
  • changed precursor handling
  • changed scan time handling