Skip to content

Latest commit

 

History

History
62 lines (40 loc) · 2.93 KB

CHANGELOG.md

File metadata and controls

62 lines (40 loc) · 2.93 KB

Change Log

v0.1.1 (2018-04-11)

Full Changelog

Implemented enhancements:

Fixed bugs:

  • Fluorine considered metal #24
  • Fix mistake in metal SMARTS #25 (mcs07)

Closed issues:

  • MolVS 0.1.0 Standardization fails on Python 3 #22
  • molvs hugs on some molecules #21

v0.1.0 (2018-02-07)

Full Changelog

Implemented enhancements:

  • Add support for using conda in development #19 (mcs07)

Fixed bugs:

  • error standardizing ionization #15
  • Molecule did not standardise overnight #14
  • Problem with __repr__ method of TautomerTransform class #7
  • Fixed forced charge corrections #18 (mcs07)
  • Fixing infinite loop issue in reionization code #17 (coleb)
  • Fix TautomerTransform repr - fixes #7 #8 (mcs07)

v0.0.9 (2017-01-27)

Full Changelog

v0.0.8 (2016-12-12)

Full Changelog

Fixed bugs:

  • Standardizer gets stuck on a molecule #4
  • Fix reionizer infinite loop - fixes #4 #5 (mcs07)

v0.0.7 (2016-12-04)

Full Changelog

v0.0.6 (2016-12-04)

Full Changelog

v0.0.5 (2016-02-15)

Full Changelog

v0.0.4 (2016-01-05)

Full Changelog

v0.0.3 (2014-08-19)

Full Changelog

v0.0.2 (2014-08-06)