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Enable link-time-optimization where available CMake Build Matrix #939: Commit 22afa7e pushed by ghutchis
November 21, 2023 18:45 1h 28m 21s enable-lto
enable-lto
November 21, 2023 18:45 1h 28m 21s
Don't show PNG files in the filter dialog CMake Build Matrix #938: Commit a68636a pushed by ghutchis
November 21, 2023 18:45 1h 19m 6s filter-out-png-files
filter-out-png-files
November 21, 2023 18:45 1h 19m 6s
Install ligand and functional group fragments CMake Build Matrix #937: Commit c6afa7e pushed by ghutchis
November 20, 2023 01:20 1h 23m 0s install-template-fragments
install-template-fragments
November 20, 2023 01:20 1h 23m 0s
[no-ci] Fix a few remaining cases of .. instead of ellipsis character CMake Build Matrix #936: Commit 5916cbb pushed by ghutchis
November 19, 2023 16:48 1h 17m 21s fix-ellipses
fix-ellipses
November 19, 2023 16:48 1h 17m 21s
Add better tooltip CMake Build Matrix #935: Commit c3d124f pushed by ghutchis
November 19, 2023 13:32 1h 19m 17s add-template-library
add-template-library
November 19, 2023 13:32 1h 19m 17s
Fix formatting CMake Build Matrix #934: Commit a35d7f7 pushed by ghutchis
November 19, 2023 05:02 6h 0m 59s add-template-library
add-template-library
November 19, 2023 05:02 6h 0m 59s
Add support for inserting fragments from library CMake Build Matrix #933: Commit c1ea51e pushed by ghutchis
November 19, 2023 04:46 17m 10s add-template-library
add-template-library
November 19, 2023 04:46 17m 10s
Merge pull request #1454 from ghutchis/fixup-script-energy CMake Build Matrix #932: Commit 35c84ce pushed by ghutchis
November 16, 2023 18:31 1h 17m 37s master
master
November 16, 2023 18:31 1h 17m 37s
Fix GFN-FF energy - redirect GFN-FF output through a hack CMake Build Matrix #931: Commit 9f53d4c pushed by ghutchis
November 14, 2023 20:39 1h 38m 50s fixup-script-energy
fixup-script-energy
November 14, 2023 20:39 1h 38m 50s
[no-ci] Update Australian and Canadian localization from GB version CMake Build Matrix #930: Commit af48390 pushed by ghutchis
November 13, 2023 20:26 1h 35m 7s update-english-localization
update-english-localization
November 13, 2023 20:26 1h 35m 7s
Fix formatting CMake Build Matrix #929: Commit 8b9aef5 pushed by ghutchis
November 13, 2023 19:22 1h 37m 20s fixup-pdb-water
fixup-pdb-water
November 13, 2023 19:22 1h 37m 20s
Fix formatting CMake Build Matrix #928: Commit 606254f pushed by ghutchis
November 13, 2023 19:16 2h 24m 4s add-msgpack
add-msgpack
November 13, 2023 19:16 2h 24m 4s
Fix formatting CMake Build Matrix #927: Commit bbd5162 pushed by ghutchis
November 13, 2023 19:15 2m 54s add-msgpack
add-msgpack
November 13, 2023 19:15 2m 54s
Fix everything CMake Build Matrix #926: Commit 838c3a9 pushed by ghutchis
November 13, 2023 19:13 2m 15s add-msgpack
add-msgpack
November 13, 2023 19:13 2m 15s
Fix atomic numbers from Orca - it would read electrons not symbols CMake Build Matrix #925: Commit f86f97f pushed by ghutchis
November 13, 2023 15:28 1h 18m 32s fix-orca-elements
fix-orca-elements
November 13, 2023 15:28 1h 18m 32s
Fixup PDB reading with non-standard MD files (no element column) CMake Build Matrix #924: Commit 1ebf20d pushed by ghutchis
November 13, 2023 15:12 4h 10m 45s fixup-pdb-water
fixup-pdb-water
November 13, 2023 15:12 4h 10m 45s
More fixes CMake Build Matrix #923: Commit cd20098 pushed by ghutchis
November 4, 2023 03:42 1h 48m 40s add-cjson-spacegroup
add-cjson-spacegroup
November 4, 2023 03:42 1h 48m 40s
Fix include CMake Build Matrix #922: Commit cffad91 pushed by ghutchis
November 4, 2023 03:39 3m 51s add-cjson-spacegroup
add-cjson-spacegroup
November 4, 2023 03:39 3m 51s
Fix compile error CMake Build Matrix #921: Commit 3c2a2ce pushed by ghutchis
November 4, 2023 03:38 1m 16s add-cjson-spacegroup
add-cjson-spacegroup
November 4, 2023 03:38 1m 16s
Add support for Hall number and space group to CJSON read/write CMake Build Matrix #920: Commit df60754 pushed by ghutchis
November 4, 2023 03:33 5m 4s add-cjson-spacegroup
add-cjson-spacegroup
November 4, 2023 03:33 5m 4s
Bump version number to 1.98.1 for bugfix CMake Build Matrix #919: Commit c97b431 pushed by ghutchis
November 2, 2023 15:46 1h 49m 44s bump-1981
bump-1981
November 2, 2023 15:46 1h 49m 44s
Merge pull request #1434 from OpenChemistry/readme-changes CMake Build Matrix #918: Commit 6b11171 pushed by ghutchis
November 2, 2023 15:46 55s bump-1981
bump-1981
November 2, 2023 15:46 55s
Revert validation of filenames. CMake Build Matrix #917: Commit af73338 pushed by ghutchis
October 31, 2023 16:28 2h 26m 40s revert-validate-filenames
revert-validate-filenames
October 31, 2023 16:28 2h 26m 40s
Ensure chart is only compiled with USE_VTK CMake Build Matrix #916: Commit 773ff08 pushed by ghutchis
October 30, 2023 21:50 1h 47m 43s ir-spectra-plot
ir-spectra-plot
October 30, 2023 21:50 1h 47m 43s
More work including spectral shift, scale and blur CMake Build Matrix #915: Commit 59d2c13 pushed by ghutchis
October 30, 2023 16:42 1h 40m 46s ir-spectra-plot
ir-spectra-plot
October 30, 2023 16:42 1h 40m 46s