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New forcefield framework
CMake Build Matrix #2359: Pull request #1370 synchronize by ghutchis
October 23, 2023 18:27 2h 6m 44s ghutchis:new-forcefield-framework
October 23, 2023 18:27 2h 6m 44s
Migrated type defs and changed const to constexpr
CMake Build Matrix #2358: Pull request #1395 opened by Atharva-Kanherkar
October 23, 2023 18:07 3h 2m 28s new-code
October 23, 2023 18:07 3h 2m 28s
Merge pull request #1383 from Surajjalpun2002/change1
CMake Build Matrix #2353: Commit fd88346 pushed by ghutchis
October 23, 2023 14:00 2h 1m 3s master
October 23, 2023 14:00 2h 1m 3s
Use of constexpr instead of define
CMake Build Matrix #2352: Pull request #1390 opened by ItshMoh
October 23, 2023 09:07 1h 39m 24s ItshMoh:changes2
October 23, 2023 09:07 1h 39m 24s
changes regarding constexpr use -1
CMake Build Matrix #2351: Pull request #1389 opened by ItshMoh
October 23, 2023 08:50 1h 55m 28s ItshMoh:changes1
October 23, 2023 08:50 1h 55m 28s
New forcefield framework
CMake Build Matrix #2348: Pull request #1370 synchronize by ghutchis
October 23, 2023 00:56 2h 23m 35s ghutchis:new-forcefield-framework
October 23, 2023 00:56 2h 23m 35s
New forcefield framework
CMake Build Matrix #2347: Pull request #1370 synchronize by ghutchis
October 22, 2023 19:58 1h 49m 53s ghutchis:new-forcefield-framework
October 22, 2023 19:58 1h 49m 53s
Modernized some code, willing to work on more. #1346
CMake Build Matrix #2346: Pull request #1387 opened by ghost
October 22, 2023 19:17 2h 18m 15s modernize-chargemodel
October 22, 2023 19:17 2h 18m 15s
Merge pull request #1384 from Surajjalpun2002/change2
CMake Build Matrix #2345: Commit 18a6ac5 pushed by ghutchis
October 22, 2023 18:43 1h 39m 16s master
October 22, 2023 18:43 1h 39m 16s
changes regarding use of constexpr in case of constant variables
CMake Build Matrix #2344: Pull request #1386 opened by Surajjalpun2002
October 22, 2023 13:50 1h 44m 12s master
October 22, 2023 13:50 1h 44m 12s
chore: update includes with include-what-you-use
CMake Build Matrix #2343: Pull request #1382 synchronize by ghutchis
October 21, 2023 23:27 1h 59m 57s e-b-olson:chore-update-includes
October 21, 2023 23:27 1h 59m 57s
removed a clang tidy warning about implicit narrowing conversion
CMake Build Matrix #2342: Pull request #1384 opened by Surajjalpun2002
October 21, 2023 21:39 1h 56m 0s change2
October 21, 2023 21:39 1h 56m 0s
changes regarding use of constexpr in case of constant variables
CMake Build Matrix #2341: Pull request #1383 synchronize by Surajjalpun2002
October 21, 2023 20:59 1h 46m 3s change1
October 21, 2023 20:59 1h 46m 3s
changes regarding use of constexpr in case of constant variables
CMake Build Matrix #2340: Pull request #1383 opened by Surajjalpun2002
October 21, 2023 20:55 2h 5m 30s change1
October 21, 2023 20:55 2h 5m 30s
Added cjson.py which can be used to read cjson
CMake Build Matrix #2339: Pull request #1360 synchronize by adityaomar3
October 21, 2023 12:51 2h 16m 52s adityaomar3:manipulating-cjson
October 21, 2023 12:51 2h 16m 52s
New forcefield framework
CMake Build Matrix #2333: Pull request #1370 synchronize by ghutchis
October 21, 2023 04:07 1h 45m 47s ghutchis:new-forcefield-framework
October 21, 2023 04:07 1h 45m 47s
Merge pull request #1381 from Surajjalpun2002/dihedraliterator_1
CMake Build Matrix #2332: Commit cda8b3c pushed by ghutchis
October 20, 2023 03:01 1h 42m 22s master
October 20, 2023 03:01 1h 42m 22s
New forcefield framework
CMake Build Matrix #2331: Pull request #1370 synchronize by ghutchis
October 20, 2023 01:18 2h 18m 23s ghutchis:new-forcefield-framework
October 20, 2023 01:18 2h 18m 23s
!valid always returns false and hence is unnecessary
CMake Build Matrix #2330: Pull request #1381 opened by Surajjalpun2002
October 19, 2023 15:14 2h 5m 33s dihedraliterator_1
October 19, 2023 15:14 2h 5m 33s
Merge pull request #1372 from weblate/weblate-avogadro-avogadrolibs
CMake Build Matrix #2329: Commit 23e27fe pushed by ghutchis
October 19, 2023 14:27 2h 19m 27s master
October 19, 2023 14:27 2h 19m 27s
Translations update from Hosted Weblate
CMake Build Matrix #2328: Pull request #1372 synchronize by weblate
October 19, 2023 02:33 1h 46m 38s weblate:weblate-avogadro-avogadrolibs
October 19, 2023 02:33 1h 46m 38s
Merge pull request #1380 from ghutchis/reading-fchk-vibrations
CMake Build Matrix #2327: Commit 62eecfc pushed by ghutchis
October 19, 2023 02:09 2h 3m 12s master
October 19, 2023 02:09 2h 3m 12s
Reading Gaussian fchk vibrations when present
CMake Build Matrix #2326: Pull request #1380 synchronize by ghutchis
October 19, 2023 00:06 1h 39m 15s ghutchis:reading-fchk-vibrations
October 19, 2023 00:06 1h 39m 15s