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[git/dxtbx] master: Use struct not numpy to unpack the bytestring. (#2) (19f630c)
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DXTBX commit |
Wed, 22 May 2019 12:13:42 +0100 |
195 lines |
[git/dxtbx] master: split up test (4ee5585)
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DXTBX commit |
Tue, 21 May 2019 13:28:08 +0100 |
87 lines |
[git/dxtbx] master: Run flake8 tests during testing stage (933a521)
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DXTBX commit |
Wed, 29 May 2019 21:35:29 +0100 |
161 lines |
[git/dxtbx] master: Run flake8 only on pull requests (2ca91ad)
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DXTBX commit |
Wed, 29 May 2019 21:39:33 +0100 |
97 lines |
[git/dxtbx] master: Revert unicode cbf changes. (dbe6803)
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DXTBX commit |
Fri, 17 May 2019 09:27:34 -0700 |
183 lines |
[git/dxtbx] master: Revert FormatSMVJHSim (692baf7)
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DXTBX commit |
Fri, 10 May 2019 09:39:45 +0100 |
117 lines |
[git/dxtbx] master: Reverse definitions of detector size (f0f3e1e)
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DXTBX commit |
Fri, 17 May 2019 15:40:32 +0100 |
140 lines |
[git/dxtbx] master: Rename serialize.load_path to resolve_path (#23) (2a9714d)
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DXTBX commit |
Tue, 28 May 2019 11:44:17 +0100 |
1115 lines |
[git/dxtbx] master: Reject commits w/ merge conflicts or large files (db23201)
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DXTBX commit |
Wed, 15 May 2019 11:58:05 +0100 |
83 lines |
[git/dxtbx] master: refactoring: avoid 'unicode', simplify code (2547fbb)
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DXTBX commit |
Thu, 16 May 2019 22:57:52 +0100 |
168 lines |
[git/dxtbx] master: Raise a Sorry when invalid image passed (56d9601)
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DXTBX commit |
Fri, 10 May 2019 04:27:02 +0100 |
281 lines |
[git/dxtbx] master: Py2/3 more Unicode -> bytes in cbf land (0f31f2b)
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DXTBX commit |
Thu, 16 May 2019 16:36:30 -0700 |
1572 lines |
[git/dxtbx] master: Py2/3 metaclass (e987b8a)
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DXTBX commit |
Thu, 16 May 2019 10:39:25 -0700 |
133 lines |
[git/dxtbx] master: Py 2/3: handle strings in cbflib (5e69ff6)
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DXTBX commit |
Thu, 16 May 2019 15:29:24 -0700 |
1812 lines |
[git/dxtbx] master: pacify flake8 (c7f0162)
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DXTBX commit |
Thu, 30 May 2019 07:53:57 +0100 |
114 lines |
[git/dxtbx] master: overload Crystal.set_unit_cell() to accept an actual unit_cell object (88b23ec)
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DXTBX commit |
Tue, 21 May 2019 13:28:08 +0100 |
235 lines |
[git/dxtbx] master: Move dxtbx extensions from dxtbx.* to dxtbx.ext.* (a6773c6)
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DXTBX commit |
Wed, 29 May 2019 14:41:26 +0100 |
195 lines |
[git/dxtbx] master: map not subscriptable (c28cc4a)
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DXTBX commit |
Thu, 16 May 2019 16:08:46 +0100 |
88 lines |
[git/dxtbx] master: Make error message slightly more useful (dca41d4)
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DXTBX commit |
Fri, 17 May 2019 12:03:30 +0100 |
130 lines |
[git/dxtbx] master: Invert FPE defaults for dxtbx (#28) (558119d)
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DXTBX commit |
Wed, 29 May 2019 13:08:01 +0100 |
131 lines |
[git/dxtbx] master: Horrible hack (ebe7369)
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DXTBX commit |
Fri, 17 May 2019 16:19:26 +0100 |
106 lines |
[git/dxtbx] master: forward compatibility (510921d)
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DXTBX commit |
Thu, 16 May 2019 11:00:54 +0100 |
168 lines |
[git/dxtbx] master: Fix test (b42f70b)
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DXTBX commit |
Wed, 29 May 2019 19:41:47 +0100 |
93 lines |
[git/dxtbx] master: Fix format class hierarchy (1ee0d9c)
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DXTBX commit |
Thu, 30 May 2019 07:53:57 +0100 |
118 lines |
[git/dxtbx] master: Fix DeprecationWarnings caused by dxtbx.ext move (f007bbc)
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DXTBX commit |
Wed, 29 May 2019 19:51:45 +0100 |
498 lines |
[git/dxtbx] master: File refactoring (f1a5e55)
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DXTBX commit |
Thu, 16 May 2019 16:31:25 +0100 |
1630 lines |
[git/dxtbx] master: enable proper pre-commits for dxtbx (b47ddc2)
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DXTBX commit |
Fri, 3 May 2019 12:39:55 +0100 |
143 lines |
[git/dxtbx] master: Enable precommitbx nagging (099d878)
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DXTBX commit |
Fri, 24 May 2019 21:57:53 +0100 |
90 lines |
[git/dxtbx] master: Consistent trusted_range for FormatSMVADSC etc. (5e6cbae)
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DXTBX commit |
Wed, 8 May 2019 13:56:01 +0100 |
673 lines |
[git/dxtbx] master: Combine all __future__ imports into one statement (8094491)
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DXTBX commit |
Thu, 2 May 2019 15:06:24 +0100 |
112 lines |
[git/dxtbx] master: cleanup (c6b2624)
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DXTBX commit |
Mon, 13 May 2019 08:00:41 +0100 |
109 lines |
[git/dxtbx] master: Clean clutter (52bb9cb)
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DXTBX commit |
Sun, 5 May 2019 05:10:21 +0100 |
119 lines |
[git/dxtbx] master: clean clutter (139877c)
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DXTBX commit |
Thu, 16 May 2019 16:05:03 +0100 |
180 lines |
[git/dxtbx] master: Clean clutter (043d9a1)
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DXTBX commit |
Sun, 26 May 2019 05:10:26 +0100 |
127 lines |
[git/dxtbx] master: Back out one of the unicode changes to make the tests pass again. (29943ce)
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DXTBX commit |
Thu, 16 May 2019 15:56:38 -0700 |
91 lines |
Jenkins 5a cctbx Tests build 8381 Fixed
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DLS Jenkins |
Wed, 22 May 2019 11:01:31 +0100 |
42 lines |
Jenkins 5a cctbx Tests build 8377 Unstable
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DLS Jenkins |
Wed, 22 May 2019 00:05:40 +0100 |
52 lines |
Jenkins 5a cctbx Tests build 8352 Fixed
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DLS Jenkins |
Fri, 17 May 2019 16:28:00 +0100 |
43 lines |
Jenkins 5a cctbx Tests build 8351 Unstable
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DLS Jenkins |
Fri, 17 May 2019 15:54:20 +0100 |
52 lines |
Jenkins 5a cctbx Tests build 8346 Fixed
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DLS Jenkins |
Fri, 17 May 2019 00:09:16 +0100 |
43 lines |
Jenkins 5a cctbx Tests build 8345 Unstable
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DLS Jenkins |
Thu, 16 May 2019 23:41:28 +0100 |
284 lines |
[git/cctbx_project] master: yet even more changes towards a gui (34d260c2f)
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CCTBX commit |
Mon, 20 May 2019 19:09:39 +0100 |
385 lines |
[git/cctbx_project] master: Use the center of mass (com) for the centroid definition for small cell. (ffe84f12a)
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CCTBX commit |
Thu, 9 May 2019 05:24:44 +0900 |
175 lines |
[git/cctbx_project] master: Use import flex (6069c0e31)
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CCTBX commit |
Tue, 14 May 2019 14:31:06 -0700 |
86 lines |
[git/cctbx_project] master: Update test for sequence cif, stop _struct_ref_seq checks until cif output is reworked (c6852e7b9)
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CCTBX commit |
Wed, 15 May 2019 16:13:20 -0700 |
328 lines |
[git/cctbx_project] master: update repository location (6e9db339f)
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CCTBX commit |
Tue, 14 May 2019 10:45:25 +0100 |
88 lines |
[git/cctbx_project] master: Update boilerplate to save results (98a8762a1)
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CCTBX commit |
Fri, 10 May 2019 08:36:51 -0700 |
109 lines |
[git/cctbx_project] master: un-cluttering (d9e7c78cc)
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CCTBX commit |
Mon, 13 May 2019 21:38:58 +0100 |
82 lines |
[git/cctbx_project] master: un-cluttering (6ad3b0cd3)
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CCTBX commit |
Tue, 14 May 2019 20:34:39 +0100 |
81 lines |
[git/cctbx_project] master: Towards making sockets between NGLHKLviewerGui.py and cmdlinesframe.py (63de2e2f3)
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CCTBX commit |
Wed, 15 May 2019 18:07:47 +0100 |
368 lines |
[git/cctbx_project] master: Towards allowing phil input exclusively for controlling the viewer (29f2d288c)
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CCTBX commit |
Mon, 13 May 2019 18:10:08 +0100 |
603 lines |
[git/cctbx_project] master: switched rotalyze to use program template (bc5c8598b)
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CCTBX commit |
Thu, 23 May 2019 15:14:34 -0400 |
422 lines |
[git/cctbx_project] master: switched clashscore to use program template (0b402ba93)
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CCTBX commit |
Thu, 23 May 2019 15:14:34 -0400 |
597 lines |
[git/cctbx_project] master: switched cbetadev to use program template (b940da5e6)
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CCTBX commit |
Thu, 23 May 2019 15:14:34 -0400 |
385 lines |
[git/cctbx_project] master: switched cablam to using program template, fixed filename printing in oneline (84a0aca1c)
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CCTBX commit |
Thu, 23 May 2019 15:14:34 -0400 |
877 lines |
[git/cctbx_project] master: stub for more detailed metal coordination filtering (27413a55e)
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CCTBX commit |
Thu, 16 May 2019 15:19:29 -0700 |
140 lines |
[git/cctbx_project] master: strange reason for test failure (83c4cabd2)
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CCTBX commit |
Thu, 16 May 2019 16:15:46 -0700 |
101 lines |
[git/cctbx_project] master: spellcheck (5ec60685b)
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CCTBX commit |
Thu, 23 May 2019 09:42:04 +0100 |
99 lines |
[git/cctbx_project] master: Sort runs for run stats standalone (879d0cf25)
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CCTBX commit |
Wed, 8 May 2019 11:32:55 -0700 |
92 lines |
[git/cctbx_project] master: some more bugfixes (97f558692)
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CCTBX commit |
Mon, 20 May 2019 14:26:55 -0700 |
219 lines |
[git/cctbx_project] master: Skip test if monomer library not present (2b19fb7b5)
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CCTBX commit |
Wed, 22 May 2019 10:53:00 +0100 |
132 lines |
[git/cctbx_project] master: Resize main window to fit screen on application start if display size is too small (eeed4dc7c)
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CCTBX commit |
Thu, 9 May 2019 02:09:39 +0900 |
97 lines |
[git/cctbx_project] master: Reorder intensity statistics to odd, even, all. (3de3d86df)
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CCTBX commit |
Thu, 23 May 2019 11:45:10 -0700 |
142 lines |
[git/cctbx_project] master: Remove imports (90c04d77c)
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CCTBX commit |
Wed, 22 May 2019 21:42:03 -0700 |
118 lines |
[git/cctbx_project] master: Remove bare printing (2b5e107fcd)
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CCTBX commit |
Fri, 31 May 2019 12:49:29 +0800 |
114 lines |
[git/cctbx_project] master: Refactor nonbonded_overlaps: use program template. (91181a149)
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CCTBX commit |
Mon, 13 May 2019 13:02:27 -0700 |
1587 lines |
[git/cctbx_project] master: Reactivate flex. Dont trust findimports... (54516c0a7)
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CCTBX commit |
Tue, 21 May 2019 23:29:35 -0700 |
87 lines |
[git/cctbx_project] master: ProgramTemplate: handle cases where the output PHIL scope may not exist (1a71792f7f)
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CCTBX commit |
Wed, 29 May 2019 15:21:39 -0700 |
125 lines |
[git/cctbx_project] master: Process nonbonded proxies: stub for Hbonds class (d66038eaa)
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CCTBX commit |
Fri, 24 May 2019 13:21:50 -0700 |
411 lines |
[git/cctbx_project] master: plotting bugfixes (dc3720bf2)
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CCTBX commit |
Thu, 16 May 2019 18:01:10 -0700 |
1845 lines |
[git/cctbx_project] master: Output more detailed intensity statistics, create new worker for output, use os.path.join instead of '/'. (6bca89413)
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CCTBX commit |
Tue, 21 May 2019 12:16:10 -0700 |
408 lines |
[git/cctbx_project] master: Output more detailed intensity statistics, create new worker for output (09cb987a7)
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CCTBX commit |
Tue, 21 May 2019 17:26:31 -0700 |
1137 lines |
[git/cctbx_project] master: not importing numpy (dc4ad9b03e)
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CCTBX commit |
Tue, 28 May 2019 20:31:50 +0100 |
95 lines |
[git/cctbx_project] master: Nonbonded overlaps: use model class, adapt tests, command line tool can read cif files. (a25541080)
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CCTBX commit |
Tue, 14 May 2019 14:04:47 -0700 |
1745 lines |
[git/cctbx_project] master: Nonbonded overlaps: better phil parameter names and clean up of unused parameters. (57ea1f69b)
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CCTBX commit |
Tue, 14 May 2019 16:04:22 -0700 |
439 lines |
[git/cctbx_project] master: needed to work with non-loop restraints (ef6265d77)
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CCTBX commit |
Thu, 16 May 2019 15:19:29 -0700 |
87 lines |
[git/cctbx_project] master: NBOs: refactor tests (5114803a8)
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CCTBX commit |
Sat, 18 May 2019 23:00:41 -0700 |
1629 lines |
[git/cctbx_project] master: NBOs: No need for filenames in phil scope. (6229b6049)
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CCTBX commit |
Tue, 14 May 2019 17:19:48 -0700 |
204 lines |
[git/cctbx_project] master: NBO: transfer test. (b95f4c4e5)
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CCTBX commit |
Fri, 17 May 2019 15:29:58 -0700 |
506 lines |
[git/cctbx_project] master: NBO: stub for new class. (e26864c29)
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CCTBX commit |
Wed, 15 May 2019 22:34:41 -0700 |
348 lines |
[git/cctbx_project] master: NBO: sort_clashes method, is_clashing method. Plus tests. (74c9d8edc)
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CCTBX commit |
Mon, 20 May 2019 12:39:04 -0700 |
633 lines |
[git/cctbx_project] master: NBO: Remove unnecessary check. Activate test. (3859d4053)
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CCTBX commit |
Tue, 21 May 2019 15:05:56 -0700 |
183 lines |
[git/cctbx_project] master: NBO: refactoring, transfer test. (fa8ed2966)
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CCTBX commit |
Sat, 18 May 2019 13:13:48 -0700 |
1409 lines |
[git/cctbx_project] master: NBO: refactor the class (5f13bf983)
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CCTBX commit |
Thu, 16 May 2019 22:45:51 -0700 |
1125 lines |
[git/cctbx_project] master: NBO: refactor tests. (0cd11e38a)
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CCTBX commit |
Sat, 18 May 2019 17:45:21 -0700 |
463 lines |
[git/cctbx_project] master: NBO: refactor tests to use model class. (5568470ad)
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CCTBX commit |
Wed, 15 May 2019 12:33:45 -0700 |
640 lines |
[git/cctbx_project] master: NBO: Move clashes loop to function. Better docstring. (dd4d4674c)
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CCTBX commit |
Fri, 17 May 2019 11:20:03 -0700 |
506 lines |
[git/cctbx_project] master: NBO: cleanup and docstrings. (6567ccec3)
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CCTBX commit |
Sat, 18 May 2019 23:24:01 -0700 |
407 lines |
[git/cctbx_project] master: NBO: check for monomer library. (8c96ab67d)
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CCTBX commit |
Wed, 22 May 2019 21:38:30 -0700 |
127 lines |
[git/cctbx_project] master: NBO: break up results in sym related and macro_mol overlaps. (4100e16aa)
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CCTBX commit |
Sat, 18 May 2019 14:12:53 -0700 |
1101 lines |
[git/cctbx_project] master: more plotting bugfixes (036ad1652)
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CCTBX commit |
Fri, 17 May 2019 16:59:26 -0700 |
2021 lines |
[git/cctbx_project] master: more changes towards a gui (9cc60a331)
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CCTBX commit |
Thu, 16 May 2019 18:17:38 +0100 |
973 lines |
[git/cctbx_project] master: Missing headers hint for macOS >= 10.14 (#240, #333) (d6f0f744b)
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CCTBX commit |
Mon, 20 May 2019 09:31:13 +0100 |
99 lines |
[git/cctbx_project] master: Make workers able to be ran standalone (abec745b8)
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CCTBX commit |
Fri, 10 May 2019 08:47:05 -0700 |
453 lines |
[git/cctbx_project] master: Ligand validation: use new clashes class. Cleanup. (679086e6a)
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CCTBX commit |
Wed, 22 May 2019 20:47:45 -0700 |
812 lines |
[git/cctbx_project] master: Ligand validation: adapt clashes code. Cleanup. Make test. (f5a6dda8d)
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CCTBX commit |
Tue, 21 May 2019 23:16:10 -0700 |
1220 lines |
[git/cctbx_project] master: IOTA and PRIME GUI bugfixes and tweaks (91f6f086eb)
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CCTBX commit |
Thu, 30 May 2019 09:36:41 -0700 |
800 lines |
[git/cctbx_project] master: incremental gui development (cd3c9820b)
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CCTBX commit |
Tue, 21 May 2019 17:31:58 +0100 |
1193 lines |
[git/cctbx_project] master: improved error message (ef07775d70)
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CCTBX commit |
Thu, 30 May 2019 09:40:32 -0700 |
132 lines |
[git/cctbx_project] master: Hbonds: show method, cut-off values, cleanup. (4d058d31d)
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CCTBX commit |
Fri, 24 May 2019 15:08:38 -0700 |
807 lines |
[git/cctbx_project] master: Handle mpack (384ace794)
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CCTBX commit |
Thu, 9 May 2019 08:50:58 -0700 |
110 lines |
[git/cctbx_project] master: gui changes (aba929b4c)
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CCTBX commit |
Fri, 24 May 2019 19:22:14 +0100 |
587 lines |
[git/cctbx_project] master: gui bugfixes (d3c82f9b45)
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CCTBX commit |
Tue, 28 May 2019 18:30:44 -0700 |
930 lines |
[git/cctbx_project] master: getting rid of unused imports, bare excepts (835b8053a)
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CCTBX commit |
Mon, 20 May 2019 22:51:21 +0100 |
178 lines |
[git/cctbx_project] master: further gui changes (92d84e5ec)
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CCTBX commit |
Thu, 23 May 2019 17:55:56 +0100 |
943 lines |
[git/cctbx_project] master: fixing some phil logic (61d1df1d9)
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CCTBX commit |
Wed, 22 May 2019 17:38:13 +0100 |
623 lines |
[git/cctbx_project] master: Fixes for ignoring NaN values when generating colour and radii data. GUI changes (b6d0539e86)
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CCTBX commit |
Wed, 29 May 2019 18:35:28 +0100 |
1285 lines |
[git/cctbx_project] master: Fix tls test on Windows (b56d5d9c8)
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CCTBX commit |
Fri, 10 May 2019 15:10:39 -0700 |
91 lines |
[git/cctbx_project] master: Fix longstanding bug with counting total number of lattices (ec3e4680c)
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CCTBX commit |
Thu, 9 May 2019 08:46:41 +0900 |
99 lines |
[git/cctbx_project] master: fix invalid colours when colourdata has a nan value as first element. Towards consistent display of missing data (eaa2e4ff77)
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CCTBX commit |
Thu, 30 May 2019 18:01:35 +0100 |
685 lines |
[git/cctbx_project] master: even more changes towards a gui (da8d4d767)
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CCTBX commit |
Fri, 17 May 2019 18:59:17 +0100 |
527 lines |
[git/cctbx_project] master: Don't compute min max values of arrays with nan values. Refactoring code to avoid excessive rebuilding of scenes and matching of miller arrays (cc717c4714)
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CCTBX commit |
Tue, 28 May 2019 17:28:21 +0100 |
1081 lines |
[git/cctbx_project] master: Disable intensity histogram calculations, improve comments. (d4b777ee6)
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CCTBX commit |
Thu, 23 May 2019 11:18:55 -0700 |
658 lines |
[git/cctbx_project] master: Deactivate hbond vs clash for now. (2e04c08ae)
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CCTBX commit |
Fri, 24 May 2019 17:18:29 -0700 |
93 lines |
[git/cctbx_project] master: DataManager: add function for writing MTZ files (4e4391ef4b)
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CCTBX commit |
Fri, 31 May 2019 15:14:49 -0700 |
277 lines |
[git/cctbx_project] master: corrected logic (cabb46b75)
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CCTBX commit |
Thu, 16 May 2019 15:32:02 -0700 |
92 lines |
[git/cctbx_project] master: configure: use installed scons, if available (71f4b84d7)
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CCTBX commit |
Sun, 12 May 2019 20:08:16 -0700 |
106 lines |
[git/cctbx_project] master: conda: only set dispatcher environment variables when needed (23f2e1d25)
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CCTBX commit |
Sun, 12 May 2019 19:26:35 -0700 |
162 lines |
[git/cctbx_project] master: conda: move dependencies to backup channel (04c8c4fe5b)
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CCTBX commit |
Thu, 30 May 2019 23:32:48 -0700 |
100 lines |
[git/cctbx_project] master: conda: change channels for py36 to be the same as py27 (6af789668)
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CCTBX commit |
Sun, 12 May 2019 22:53:04 -0700 |
160 lines |
[git/cctbx_project] master: CCTBXParser: bug fix for constructing working_phil (c916ba716)
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CCTBX commit |
Fri, 24 May 2019 12:51:22 -0700 |
89 lines |
[git/cctbx_project] master: Bugfixes for small cell processing using standalone GUI (4d232bbca)
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CCTBX commit |
Thu, 9 May 2019 02:09:39 +0900 |
154 lines |
[git/cctbx_project] master: Bugfix and better printout. (97e2e30866)
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CCTBX commit |
Fri, 31 May 2019 11:09:29 -0700 |
330 lines |
[git/cctbx_project] master: Bugfix (8c8603f5f)
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CCTBX commit |
Fri, 24 May 2019 15:20:27 -0700 |
129 lines |
[git/cctbx_project] master: Bug fix for standalone GUI logging directories with lots of files instead of composite files (7a5a82607)
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CCTBX commit |
Thu, 9 May 2019 07:01:58 +0900 |
285 lines |
[git/cctbx_project] master: Avoid OSError when cctbx.python is run with uwsgi (9f48c8837)
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CCTBX commit |
Fri, 10 May 2019 13:09:31 -0700 |
93 lines |
[git/cctbx_project] master: always build wxpython4 on macOS >= 10.14 (#240, #333) (e9d68f7d6)
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CCTBX commit |
Mon, 20 May 2019 09:31:13 +0100 |
113 lines |
[git/cctbx_project] master: Allowing phil input exclusively for controlling the viewer (09bf6336a)
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CCTBX commit |
Tue, 14 May 2019 18:07:22 +0100 |
726 lines |
[git/cctbx_project] master: Added NGL_HKLviewerGui.py (639c79ac0)
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CCTBX commit |
Mon, 20 May 2019 19:11:55 +0100 |
1005 lines |
[git/cctbx_project] master: Add mtz output (c1bc1e3b9)
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CCTBX commit |
Thu, 9 May 2019 11:07:59 -0700 |
310 lines |
[git/cctbx] master: Update README.md (1b6a0061a)
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CCTBX commit |
Thu, 2 May 2019 15:39:24 -0700 |
136 lines |
[git/cctbx] master: Tool to find reserved names (334ca5589)
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CCTBX commit |
Fri, 3 May 2019 07:42:18 +0100 |
154 lines |
[git/cctbx] master: Sort chains on resno and chain ID (bf61dbc6d)
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CCTBX commit |
Thu, 2 May 2019 08:01:58 -0600 |
288 lines |
[git/cctbx] master: Skip chain_type in extract_unique_part_of_hierarchy because it could be mixed (8365b54ca)
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CCTBX commit |
Wed, 1 May 2019 18:52:34 -0700 |
154 lines |
[git/cctbx] master: sequence_cif: update tests to use model class (a5833139f)
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CCTBX commit |
Fri, 3 May 2019 17:12:27 -0700 |
584 lines |
[git/cctbx] master: sequence_cif: add all residues to _entity_poly_seq.mon_id (6795b490f)
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CCTBX commit |
Fri, 3 May 2019 17:11:48 -0700 |
89 lines |
[git/cctbx] master: Return NaN if NaN submitted to roundoff() rather than crashing on Python3 (471dcb25d)
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CCTBX commit |
Fri, 3 May 2019 14:26:01 +0100 |
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[git/cctbx] master: rename tests in mmtbx to follow libtbx convention (current naming is picked up by pytest discovery, with these tests being incompatible with pytest, causing subsquent failures). change documentation and import statements involving these test modules to compensate. (a53bb2af4)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: removed unused imports that I am actually using (ae48defa0)
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Sun, 5 May 2019 09:13:32 -0700 |
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[git/cctbx] master: remove unused imports. add from __future__ import division. remove unused functions. fix typo in tests. (347e21b43)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: Remove unused import (98e178ce7)
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Wed, 1 May 2019 18:29:54 -0600 |
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[git/cctbx] master: Remove accidental commit of tmp files (4b35afc56)
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Sat, 4 May 2019 19:20:50 +0800 |
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[git/cctbx] master: refactor mmtbx/tls/optimise_amplitudes (b84037627)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: Reapply f83b17271c30e8a7aefc59cb6dc09e6e1b78d51d to new location (1e37191b7)
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Fri, 3 May 2019 14:41:55 -0700 |
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[git/cctbx] master: python class with c++ optimiser for fitting an arbitrary combination of (tls) modes against refined Us from multiple datasets. includes boost::python wrapper and pytest tests. (8c3dcf438)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: ProgramTemplate: handle case where DataManager is None (76c486f1f)
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Sat, 4 May 2019 17:59:37 -0700 |
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[git/cctbx] master: Partially Revert "Merge pull request #317 from msgpack_as_default" (57ca8299e)
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Thu, 2 May 2019 09:37:10 -0700 |
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[git/cctbx] master: Parameters to fine-tune hbond angle sigmas. (c14114868)
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Mon, 6 May 2019 17:30:56 -0700 |
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[git/cctbx] master: multiple fixes in nonsense space (d5997e85f)
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Sun, 5 May 2019 22:45:14 +0800 |
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[git/cctbx] master: Move mmCIF output of sequence loops (85158210b)
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Fri, 3 May 2019 14:41:55 -0700 |
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[git/cctbx] master: mmtbx: fix extension name (19a1b2104)
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Sat, 4 May 2019 17:28:30 -0700 |
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[git/cctbx] master: mmtbx.prepare_pdb_depostion: add PDB interpretation parameters for restraints and links (76a05b4da)
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Fri, 3 May 2019 14:41:55 -0700 |
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[git/cctbx] master: mmtbx.prepare_pdb_deposition: always construct geometry restraints manager (548c8633b)
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Fri, 3 May 2019 14:41:55 -0700 |
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[git/cctbx] master: Merge #316: Implement parts of mmtbx.TLS in C++ (2de01b24c)
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Thu, 2 May 2019 11:49:07 +0100 |
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[git/cctbx] master: Make sure gridding last is >= gridding first; set solvent fraction if not set, shift pdb_inp in segment_and_split_map (49251518a)
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Mon, 6 May 2019 10:42:55 -0700 |
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[git/cctbx] master: LV: Stub for CCs. (6e2a1d2e3)
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Fri, 3 May 2019 10:44:29 -0700 |
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[git/cctbx] master: Initialise member data in constructors rather than header files. Move function definitions to serparate cpp files rather than defining in header. Remove unnecessary includes. (3d8509456)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: fixing test. Order of setting variables matters in simtbx. whenever mosaic_spread_deg = 0 the mosaic_domains is automatically set to 1 (cc88a9b2b)
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Sun, 5 May 2019 08:44:26 -0700 |
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[git/cctbx] master: fix typo in mmtbx/tls/analysis.py (8cc18a3ab)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: fix typo (5700dc6db)
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Thu, 2 May 2019 05:45:59 -0700 |
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[git/cctbx] master: fix mosaic domain initialization bug hopefully without breaking Sauter features (884b735a7)
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Sun, 5 May 2019 08:44:26 -0700 |
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[git/cctbx] master: fix missing set of chain ID (7293edca6)
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Thu, 2 May 2019 05:03:49 -0700 |
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[git/cctbx] master: Find H bond code from Wensong. Needs more testing and optimization. (7d1634ae9)
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Sat, 4 May 2019 19:19:55 +0800 |
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[git/cctbx] master: DataManager: update default filename functions (85f78d0ee)
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Sat, 4 May 2019 19:18:54 -0700 |
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[git/cctbx] master: DataManager: unset stop_for_uknowns, no longer needed (bf8c7d7be)
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Fri, 3 May 2019 14:41:55 -0700 |
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[git/cctbx] master: DataManager: add default output filenames (ba89fd229)
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Sat, 4 May 2019 20:11:14 -0700 |
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[git/cctbx] master: DataManager: add default output filename and overwrite options (d87000681)
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Sat, 4 May 2019 17:44:13 -0700 |
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[git/cctbx] master: convert 4-space indents to 2-space indents. (d60159532)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: conda: use warning instead of error (d83b77c69)
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Mon, 6 May 2019 19:17:52 -0700 |
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[git/cctbx] master: Comparama: more arrows, more color control. (20be6745a)
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Fri, 3 May 2019 14:34:17 -0700 |
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[git/cctbx] master: Clean clutter Print label of displayed miller array (ab1a63497)
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Wed, 1 May 2019 19:25:33 +0100 |
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[git/cctbx] master: clean clutter (trailing whitespace) (ce4e7d3b0)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: Clean clutter (59ba24436)
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Thu, 2 May 2019 09:28:25 -0700 |
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[git/cctbx] master: changes for windows compatibility. change and/or to &&/||. (8bf8e6fa2)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: change pytest tests into libtbx tests. register in mmtbx.run_tests. (eee7382aa)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: c++ implementation of decomposition of TLS matrices into physical motions (Urzhumtsev 2016; mmtbx/tls/analysis.py) with boost::python wrapper. incorporate c++ implementation of decomposition into mmtbx/tls/analysis.py. add to tests, checking against python implementation. (9c9ff218f)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: c++ implementation of convenience classes for manipulating TLS matrices and extracting Us. allows multi-dataset usage of TLS matrices. includes boost::python wrapper (mmtbx/tls/utils.py). includes associated tests in pytest. (b2331ec66)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: bug fixes (57581855f)
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Tue, 7 May 2019 19:05:39 +0100 |
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[git/cctbx] master: Bug fix: filter out noise (25738dc4a)
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Wed, 1 May 2019 20:20:07 +0800 |
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[git/cctbx] master: Bug fix for unknown miller array type FOM label formatting on colour gradient chart (130a6cd07)
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Thu, 2 May 2019 18:07:26 +0100 |
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[git/cctbx] master: Better NCS groups filtering. (0d61d621b)
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Mon, 6 May 2019 13:27:57 -0700 |
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[git/cctbx] master: Avoid setting vdw radius to None in rare cases of unknown atom types (9839e81ba)
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Wed, 1 May 2019 09:57:45 +0800 |
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[git/cctbx] master: Automatic scaling of radii to ensure smallest radius is 0.25*largest radius (c5ca1309c)
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Fri, 3 May 2019 17:56:44 +0100 |
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[git/cctbx] master: allow optimization of molecule in extracting ncs au (961055df3)
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Wed, 1 May 2019 17:02:06 -0600 |
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[git/cctbx] master: added ReadMe (4fefcb2aa)
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Tue, 30 Apr 2019 23:24:29 +0100 |
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[git/cctbx] master: added new test for mosaic spread functionality (334d037e8)
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Sun, 5 May 2019 08:44:26 -0700 |
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[git/cctbx] master: Add restraints to mmCIF output from mmtbx.prepare_pdb_deposition (d9861bed3)
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Fri, 3 May 2019 14:41:55 -0700 |
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[git/cctbx] master: add pytest discovery to mmtbx/run_tests.py (bec02c711)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: add missing assert statements in tests (f9070af05)
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Wed, 1 May 2019 23:02:07 -0700 |
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[git/cctbx] master: Add get_sites_frac method (1c6e68e97)
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Fri, 3 May 2019 15:48:44 +0800 |
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[git/cctbx] master: Add delay before loading file for update (0c9f39f9d)
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Thu, 2 May 2019 22:34:08 -0700 |
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