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Releases: stuchalk/pyComChem

Version 0.3

26 Mar 15:12
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Clean up, rework of examples using functions, removal of bs4, other minor edits

Version 0.2.2

03 Jan 18:13
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Update for problems with pypi release action.

  • fixed correct server
  • updated to v4 of setup-python action

Version 0.2.1

03 Jan 17:56
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Update for problems with pypi release action.

  • fixed correct server
  • updated to v4 of setup-python action

Version 0.2

03 Jan 17:48
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First public release with basic functionality to get data from the CommonChemistry API.

release alpha6

04 Nov 17:02
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Converted interpreter to pipenv. Add selection variable to example.py file.
Updated the GitHub action to test on PyPi (with two additional config fix).

Release alpha5

04 Nov 16:59
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Converted interpreter to pipenv. Add selection variable to example.py file.
Updated the GitHub action to test on PyPi (with additional config fix).

Release alpha4

04 Nov 16:37
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Converted interpreter to pipenv. Add selection variable to example.py file.
Updated the GitHub action to test on PyPi (with config fix).

Release alpha3

04 Nov 16:32
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Converted interpreter to pipenv. Add selection variable to example.py file.
Updated the GitHub action to test on PyPi (with config fix).

Release alpha2

06 Mar 12:12
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Improved functions and added validation

  • added documentation to methods
  • added chemimg method
  • added cas validation with check digit verification
  • added inchikey validation
  • improved query to check for '*' and added exact option
  • improved key2cas to get casrn of smallest molecule (assuming other hits are polymers)

TestPyPI Package Testing

05 Mar 11:09
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Fingers crossed...