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Commits on Aug 3, 2022

• Update obminimize help message & docs (openbabel#2519)

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  DanielSabo

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Commits on Jul 28, 2022

• Add override keyword

  e-kwsm

  committed
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Commits on Jul 27, 2022

• refactor: always use std::shared_ptr (openbabel#2501)

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  e-kwsm

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Commits on Jun 9, 2022

• Merge pull request openbabel#2388 from e-kwsm/modernize-deprecated-headers

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  ghutchis

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• update help menu when calling openbabel from the CLI (openbabel#2307)

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  nbehrnd

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Commits on Jun 16, 2021

• Replace deprecated C headers with C++ alternatives

  e-kwsm

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Commits on Feb 26, 2021

• Initialize allocated memory to zero. (openbabel#2248)

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  ghutchis

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  dkoes

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Commits on Sep 28, 2020

• Fixed crash in obthermo due to pointgroup code.

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  David van der Spoel

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  7c05e0b

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Commits on May 8, 2020

• Merge pull request openbabel#2044 from e-kwsm/nullptr

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  ghutchis

  authored
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• More nullptr conversions

  ghutchis

  committed
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• Fix openbabel#2159

  

  Fredrik Wallner

  committed
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Commits on May 7, 2020

• Merge pull request openbabel#2153 from e-kwsm/improve-obenergy

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  ghutchis

  authored
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• Fix thread library link issue

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  e-kwsm

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Commits on May 6, 2020

• Replace NULL with nullptr (C++11)

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  e-kwsm

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Commits on May 3, 2020

• Fix tautomer code (openbabel#2171)

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  timvdm

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Commits on Apr 9, 2020

• Merge pull request openbabel#2154 from e-kwsm/improve-obconformer

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  ghutchis

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Commits on Apr 8, 2020

• Merge pull request openbabel#2163 from ghutchis/misspell-fixer

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  ghutchis

  authored
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• Initial GitHub action - misspell-fixer

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  ghutchis

  committed
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• Improve tools/obconformer.cpp

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  e-kwsm

  committed
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Commits on Apr 3, 2020

• Merge pull request openbabel#2073 from e-kwsm/fix-2071

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  ghutchis

  authored
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Commits on Apr 2, 2020

• Improve tools/obenergy.cpp

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  e-kwsm

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Commits on Apr 1, 2020

• Minor cleanups in iterators - should fix codacy check

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  ghutchis

  committed
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Commits on Mar 31, 2020

• Remove fragments with zero coordinates - fixes openbabel#2144.

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  ghutchis

  committed
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Commits on Nov 5, 2019

• Fix openbabel#2071

  e-kwsm

  committed
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Commits on Sep 19, 2019

• Merge remote-tracking branch 'openbabel/master' into some_tests

  dkoes

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Commits on Sep 10, 2019

• Remove babel.cpp.

  baoilleach

  committed
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Commits on May 23, 2019

• Merge branch 'openbabel_master'

  dkoes

  committed
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Commits on May 7, 2019

• Merge pull request openbabel#1973 from e-kwsm/fix-exit-code

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  baoilleach

  authored
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• Merge pull request openbabel#1965 from baoilleach/MoreSetUnset

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  baoilleach

  authored
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Commits on May 3, 2019

• Merge remote-tracking branch 'openbabel/master'

  dkoes

  committed
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• fix cmake build

  dkoes

  committed
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• Merge branch 'obrms_enhancement'

  dkoes

  committed
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Commits on Apr 27, 2019

• Merge pull request openbabel#1978 from dkoes/obrms_enhancement

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  baoilleach

  authored
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Commits on Apr 25, 2019

• Merge branch 'obrms_enhancement' of github.com:dkoes/openbabel into obrms_enhancement

  dkoes

  committed
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• fix firstonly logic and extend man page

  dkoes

  committed
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