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Parse CHELPG charges from Orca output too
CodeQL #1800: Pull request #1829 opened by ghutchis
November 30, 2024 00:23 34m 19s ghutchis:orca-chelpg
November 30, 2024 00:23 34m 19s
Merge pull request #1820 from weblate/weblate-avogadro-avogadrolibs
CodeQL #1799: Commit 2ab9f8a pushed by ghutchis
November 29, 2024 19:53 1h 25m 4s master
November 29, 2024 19:53 1h 25m 4s
Translations update from Hosted Weblate
CodeQL #1798: Pull request #1820 synchronize by weblate
November 29, 2024 19:24 1h 26m 2s weblate:weblate-avogadro-avogadrolibs
November 29, 2024 19:24 1h 26m 2s
Merge pull request #1826 from ghutchis/implement-g-orbitals
CodeQL #1797: Commit b7e4a12 pushed by ghutchis
November 29, 2024 19:23 30m 9s master
November 29, 2024 19:23 30m 9s
Merge pull request #1828 from ghutchis/update-header-comments
CodeQL #1795: Commit 3788209 pushed by ghutchis
November 29, 2024 19:23 45s master
November 29, 2024 19:23 45s
Translations update from Hosted Weblate
CodeQL #1794: Pull request #1820 synchronize by weblate
November 29, 2024 18:38 44m 29s weblate:weblate-avogadro-avogadrolibs
November 29, 2024 18:38 44m 29s
Merge pull request #1824 from ghutchis/xyz-precision
CodeQL #1793: Commit 1815c9d pushed by ghutchis
November 29, 2024 18:38 45m 17s master
November 29, 2024 18:38 45m 17s
Add decimal precision as per forum debate (10 decimals)
CodeQL #1791: Pull request #1824 synchronize by ghutchis
November 29, 2024 16:43 34m 4s ghutchis:xyz-precision
November 29, 2024 16:43 34m 4s
Translations update from Hosted Weblate
CodeQL #1790: Pull request #1820 synchronize by weblate
November 29, 2024 03:10 34m 39s weblate:weblate-avogadro-avogadrolibs
November 29, 2024 03:10 34m 39s
Merge pull request #1825 from ghutchis/insert-template-dummy
CodeQL #1789: Commit ab85ccd pushed by ghutchis
November 29, 2024 03:09 52m 45s master
November 29, 2024 03:09 52m 45s
Implement g orbitals
CodeQL #1788: Pull request #1826 synchronize by ghutchis
November 28, 2024 23:01 36m 2s ghutchis:implement-g-orbitals
November 28, 2024 23:01 36m 2s
Implement g orbitals
CodeQL #1787: Pull request #1826 opened by ghutchis
November 28, 2024 21:55 32m 36s ghutchis:implement-g-orbitals
November 28, 2024 21:55 32m 36s
Translations update from Hosted Weblate
CodeQL #1785: Pull request #1820 synchronize by weblate
November 27, 2024 23:00 43m 42s weblate:weblate-avogadro-avogadrolibs
November 27, 2024 23:00 43m 42s
Add decimal precision as per forum debate (10 decimals)
CodeQL #1784: Pull request #1824 opened by ghutchis
November 26, 2024 20:05 1h 21m 32s ghutchis:xyz-precision
November 26, 2024 20:05 1h 21m 32s
Translations update from Hosted Weblate
CodeQL #1783: Pull request #1820 synchronize by weblate
November 26, 2024 19:46 48m 48s weblate:weblate-avogadro-avogadrolibs
November 26, 2024 19:46 48m 48s
Merge pull request #1823 from ghutchis/orca-mbis
CodeQL #1782: Commit 7098118 pushed by ghutchis
November 26, 2024 19:46 53m 55s master
November 26, 2024 19:46 53m 55s
Read MBIS charges from ORCA output
CodeQL #1781: Pull request #1823 opened by ghutchis
November 26, 2024 17:21 35m 35s ghutchis:orca-mbis
November 26, 2024 17:21 35m 35s
Translations update from Hosted Weblate
CodeQL #1780: Pull request #1820 synchronize by weblate
November 26, 2024 01:23 1h 22m 37s weblate:weblate-avogadro-avogadrolibs
November 26, 2024 01:23 1h 22m 37s
Merge pull request #1822 from ghutchis/more-molecular-properties
CodeQL #1779: Commit 33007db pushed by ghutchis
November 26, 2024 01:23 1h 30m 7s master
November 26, 2024 01:23 1h 30m 7s
Translations update from Hosted Weblate
CodeQL #1778: Pull request #1820 synchronize by weblate
November 26, 2024 00:58 25m 32s weblate:weblate-avogadro-avogadrolibs
November 26, 2024 00:58 25m 32s
Merge pull request #1807 from Milziade/add-shortcuts
CodeQL #1777: Commit c6827ae pushed by ghutchis
November 26, 2024 00:57 25m 56s master
November 26, 2024 00:57 25m 56s
Support more molecular properties
CodeQL #1776: Pull request #1822 opened by ghutchis
November 25, 2024 22:23 2h 3m 32s ghutchis:more-molecular-properties
November 25, 2024 22:23 2h 3m 32s
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