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0f6a34775c
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Merge branch 'master' into symbolic-atom-constants
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2020-09-15 17:44:31 -04:00 |
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e5e449795a
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Add tests for has_style and available_styles
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2020-09-15 15:16:19 -04:00 |
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618b08dcfc
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Merge branch 'master' into symbolic-atom-constants
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2020-09-15 14:58:13 -04:00 |
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3dd3c6a2a5
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redo fix for class member shadowing while avoiding overflowing levels
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2020-09-15 14:48:55 -04:00 |
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2165f6ed38
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Merge pull request #2363 from akohlmey/consistent-memory-usage
Make memory usage reporting consistent
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2020-09-15 14:21:07 -04:00 |
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b5832191d8
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Merge pull request #2364 from akohlmey/force-test-bugfix
Force style unit test template bugfix
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2020-09-15 13:40:13 -04:00 |
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2f3c916a57
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add unit test for lammps_memory_usage()
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2020-09-15 12:29:03 -04:00 |
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165444004e
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Merge pull request #2362 from akohlmey/library-progguide
Updates to C-Library interface progammer guide and reference
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2020-09-15 11:51:02 -04:00 |
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4a48ce76b8
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Merge remote-tracking branch 'origin/master' into python_interface_guide
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2020-09-15 11:34:16 -04:00 |
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c6bc21febf
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Merge pull request #2361 from akohlmey/collected-small-changes
Collected small changes for the next patch release
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2020-09-15 11:28:25 -04:00 |
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b20b234ebe
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Merge remote-tracking branch 'origin/master' into python_interface_guide
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2020-09-15 10:45:28 -04:00 |
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e30864431f
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add test for missing quartic bond style
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2020-09-15 10:12:18 -04:00 |
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238730b13d
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update epsilon
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2020-09-15 09:55:58 -04:00 |
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c6b6369d2d
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fix bug in input script templates that would have the timestep setting overwritten by a units command
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2020-09-15 09:46:57 -04:00 |
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bc31486fd1
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start tests for lammps_extract_global()
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2020-09-15 09:27:07 -04:00 |
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d27d4912af
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test lammps_extract_settings()
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2020-09-14 20:53:19 -04:00 |
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1e54a9fcf1
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complete tests for extracting and resetting the box
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2020-09-14 20:27:29 -04:00 |
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5c7f67201b
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make naming more consistent
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2020-09-14 20:27:10 -04:00 |
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93bd851ab0
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fix typo
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2020-09-14 17:39:31 -04:00 |
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a1b2f82107
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test for exceptions add example
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2020-09-14 17:01:28 -04:00 |
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4185608e92
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complete testing for LAMMPS configuration queries
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2020-09-14 14:56:56 -04:00 |
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b455812434
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more tests for properties and configuration
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2020-09-14 14:25:17 -04:00 |
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f4601235c9
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add tests for lammps configuration introspection via library interface
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2020-09-14 12:17:24 -04:00 |
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2438f38afc
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skip test if atom style is missing
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2020-09-13 17:12:21 -04:00 |
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a2fc33b419
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update c-library tests
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2020-09-13 17:02:32 -04:00 |
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fcb38354dc
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import adapted example input deck
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2020-09-13 16:47:29 -04:00 |
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39255da6ae
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use common main function that allows handling of common command line flags.
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2020-09-13 16:46:59 -04:00 |
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69962b4de5
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add test for MSM kspace without periodic boundaries
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2020-09-12 11:10:38 -04:00 |
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47b3039b28
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update unit tests, too
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2020-09-11 19:24:32 -04:00 |
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77d475d121
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Add more tests
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2020-09-11 15:48:23 -04:00 |
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58833ce11e
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Add API tests
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2020-09-11 15:21:36 -04:00 |
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1855f92694
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Use include and omit
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2020-09-11 12:44:41 -04:00 |
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377163d940
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Add target to generate Python coverage XML
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2020-09-11 11:36:22 -04:00 |
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97000fa016
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Merge remote-tracking branch 'origin/master' into python_interface_guide
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2020-09-11 09:48:28 -04:00 |
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e813e2d30a
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add minimal unit test for lammps_get_mpi_comm() API
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2020-09-09 22:12:47 -04:00 |
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e6d340aee1
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Merge branch 'master' into gpu-unittest
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2020-09-09 14:39:29 -04:00 |
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f4c4c62349
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adjust test to updated API
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2020-09-09 09:27:34 -04:00 |
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a3cc7581b1
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rename test for memory pools
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2020-09-08 15:12:08 -04:00 |
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0ee7c5f434
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add more MyPage test variants
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2020-09-07 15:27:13 -04:00 |
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ab5c81f7d6
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refactor some more to reduce redundant code.
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2020-09-07 08:57:37 -04:00 |
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bbb81a8dd0
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add unit tester for MyPage class
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2020-09-07 08:33:05 -04:00 |
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64728678f1
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Merge branch 'python_interface_guide' of github.com:rbberger/lammps into python_interface_guide
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2020-09-04 17:15:58 -04:00 |
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96db122377
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Add Python coverage collection if enabled
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2020-09-04 17:15:51 -04:00 |
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ceed9284c1
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Merge branch 'master' into collected-small-changes
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2020-09-04 13:32:47 -04:00 |
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f19ce32bf5
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a few more small tweaks
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2020-09-04 09:42:11 -04:00 |
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ce78be864a
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move date2num() convernience function from Universe class to utils namespace
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2020-09-03 17:47:45 -04:00 |
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12aa689e97
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fix typo in cfg/zstd tester tool
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2020-09-02 13:38:18 -04:00 |
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c50a82af78
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apply consistent naming scheme for tester source files and executables
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2020-09-01 20:16:39 -04:00 |
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2ffb5ddd5a
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add kspace dependency to coul/streitz/long test
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2020-09-01 17:34:08 -04:00 |
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31bd76efa5
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Merge remote-tracking branch 'origin/master' into zstd_support
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2020-09-01 12:58:41 -04:00 |
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