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DIALS-COMMIT Archives


June 2016


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Table of Contents:

[git/dials] master: 1.2.5 released (d3ef762) (1 message)
[git/dials] master: Add isoform refinement to the stills indexer. (fff3ca5) (1 message)
[git/dials] master: Add mask=filename to dials.image_viewer for easy viewing of dials mask files. (9828fc8) (1 message)
[git/dials] master: Add option to only display integrated reflections (630e22c) (1 message)
[git/dials] master: Add option to only show integration shoeboxes (b09455e) (1 message)
[git/dials] master: Add refinement paper to publications.html (910155c) (1 message)
[git/dials] master: Added gain to spot finding (e6e2c52) (1 message)
[git/dials] master: Allow indexing for data imported from XDS SPOT.XDS (f484810) (1 message)
[git/dials] master: Allow setting frames; helps with datablock.json (540acf4) (1 message)
[git/dials] master: Allow z-min z-max in rlv; fixes #145 (bbe3278) (1 message)
[git/dials] master: Also changed moslfm to plane here (1d1cdfa) (1 message)
[git/dials] master: avoid double call of _get_flex_image() on loading of new image (039b3c6) (1 message)
[git/dials] master: Bug fix (4a24459) (1 message)
[git/dials] master: bug fix for display of unindexed reflections from integrated.pickle (8c39ec3) (1 message)
[git/dials] master: cache frame number for scan-varying paramterisations to avoid composing more than once (5bfdaa6) (1 message)
[git/dials] master: Catch no reflection in input and raise Sorry (fda54e6) (1 message)
[git/dials] master: Changed outlier name from mosflm to plane as suggested by reviewer (f3aab5b) (1 message)
[git/dials] master: Check make exit codes and stop on error (6d0366d) (1 message)
[git/dials] master: Clean code some; add summary information; FIXME should re-use resolution array (bf14998) (1 message)
[git/dials] master: consistent use of EOF vs eof in heredocs in documentation (02edfc4) (1 message)
[git/dials] master: correction for revision e584ac9 - the method exists in Pillow, it just raises Exception (ed46252) (1 message)
[git/dials] master: defluff installer, fixes #149 (937a231) (1 message)
[git/dials] master: dials.export: change default output name hklout -> integrated (52041f9) (1 message)
[git/dials] master: dials.stills_process: accept json files, not just raw images. Allows using dials.import with overrides like mosflm_beam_center. (68a5094) (1 message)
[git/dials] master: Did clean cluter (c4a53af) (1 message)
[git/dials] master: Documentation for the distl/dials apache spotfinder server. (13963a7) (1 message)
[git/dials] master: Exclude further directories from installer (b7ad223) (1 message)
[git/dials] master: Expose hard-coded parameters for stills indexing: (3f9c49d) (1 message)
[git/dials] master: Fail test if dials.import fails (d59f9ff) (1 message)
[git/dials] master: Feedback from DESY: make workshop proceedings more visible by putting them in their own page, not 'Links'. Move Framework Report to Publications (01bb483) (1 message)
[git/dials] master: fix dials.background (411daeb) (1 message)
[git/dials] master: fix documentation (ff5cb2e) (1 message)
[git/dials] master: Fix documnentation (a4a89ec) (1 message)
[git/dials] master: Fix for #155 view predictions in RLV (e8dfddb) (1 message)
[git/dials] master: fix for #156 (62dbb4a) (1 message)
[git/dials] master: Fix ice ring filtering for blank images (f44b64c) (1 message)
[git/dials] master: Fix indentation of comments (d792fa0) (1 message)
[git/dials] master: fix README (1606df6) (1 message)
[git/dials] master: fix some sphinx warnings (3db12e0) (1 message)
[git/dials] master: Fixed a bug in idials (c0bd4e5) (1 message)
[git/dials] master: Fixed bug (7aab8e2) (1 message)
[git/dials] master: Fixed for HDF5 files in multiple jobs and processes. Need to make sure file is closed because of fork behaviour in python multiprocessing. Fixes #144 (b19510e) (1 message)
[git/dials] master: Fixed test (d5670f6) (1 message)
[git/dials] master: fixes #166 (bug probably introduced by 039b3c679fd5a7c5e5c78fdacc3e9a805cb6d65c) (a04434d) (1 message)
[git/dials] master: Fixes for plotting integrated experiments and reflections when using multi-panel detector e.g. I23 (518d136) (1 message)
[git/dials] master: FIXME for single image integration (6e40dc6) (1 message)
[git/dials] master: FIXME; I think yes (7c4ebcd) (1 message)
[git/dials] master: Follow on from 6d7cd98, also use C++ helper class in scan-varying parameterisations for small but significant time savings (c53f070) (1 message)
[git/dials] master: For stills integration, remove reflections with at least one bad foreground pixel. (e73416d) (1 message)
[git/dials] master: Further to #166: Only update view if any value has changed. Means you can still tab/click through the parameters without freezing (5ca25c9) (1 message)
[git/dials] master: image_viewer optimisations when no spots to display (28a845f) (1 message)
[git/dials] master: Improved error message: although dmin is the variable name, d_min is what the user sees via phil (a7945b3) (1 message)
[git/dials] master: Is this a bug? (4b993a2) (1 message)
[git/dials] master: Key control of view; use up/down/left/right for big moves; shift+same for finer control (0.1*scale); fixes #142 (1b1b82b) (1 message)
[git/dials] master: missing print >> out (549568d) (1 message)
[git/dials] master: Missing Sorry() imports lead to hilarious tracebacks. (6cc2028) (1 message)
[git/dials] master: more debug output for find_max_cell (d37da74) (1 message)
[git/dials] master: more refactoring (07cba11) (1 message)
[git/dials] master: more refactoring (14e1c16) (1 message)
[git/dials] master: More sensible caching and return of derivatives for multi-state parameterisations; also clean up dead code (7b3d9ac) (1 message)
[git/dials] master: More warnings that should probably be debug (5a4a1fd) (1 message)
[git/dials] master: move a shared method to a base class (6e0d1e4) (1 message)
[git/dials] master: Move background to dials.background; philling (71005cf) (1 message)
[git/dials] master: Move sim_mx data to dials_regression. Update tests. Suggested change for #149 (e012b64) (1 message)
[git/dials] master: move workshops page to the correct place; add more links and contact information (b4e6001) (1 message)
[git/dials] master: Moved controller part of idials to util/idials so it can be incorporated into GUI (c0ea570) (1 message)
[git/dials] master: Moved import of scipy so that it's always before any cctbx modues (90d437a) (1 message)
[git/dials] master: no need to recalculate bin tt values as already calculated by histogram code (27623bd) (1 message)
[git/dials] master: Now _get_gradients_core is the same in all derived classes, so move it to the base class get_gradients method (84a99bf) (1 message)
[git/dials] master: option to generate plot of background intensity vs resolution (c7a3315) (1 message)
[git/dials] master: P1 is a special case (8fce7f0) (1 message)
[git/dials] master: Potential workaround for group frames that have zero distance. @rjgildea Does this work now? (6fcb0cb) (1 message)
[git/dials] master: print out auto value of mp_chunksize (c6df3b6) (1 message)
[git/dials] master: print table of bravais lattice to space groups in dials.refine_bravais_settings (0c6f8e7) (1 message)
[git/dials] master: Propagate stdout/stderr so that GUI can intercept. Also make running command asynchronous, with mutex locks to ensure that nothing gets messed up. (3930e61) (1 message)
[git/dials] master: Putative fix for #107; involves not showing masks if sum_images != 1 (89e0a64) (1 message)
[git/dials] master: refactoring to improve code reusability (a6acda9) (1 message)
[git/dials] master: remove unused parameter (58279c2) (1 message)
[git/dials] master: Removed absolute paths in state file. (1d9dee7) (1 message)
[git/dials] master: removing commented and no longer needed test print (e392d98) (1 message)
[git/dials] master: Sanity check: closes #165 (15936e1) (1 message)
[git/dials] master: Say what we are using (08176a5) (1 message)
[git/dials] master: Send to debug instead to suppress excessive number of these warnings appearing in the user log (c29c10e) (1 message)
[git/dials] master: Set chunksize to auto; fixes #150 (5cbe9ac) (1 message)
[git/dials] master: Setting reflections_per_degree may be beneficial for large scan-varying refinement jobs to reduce memory use. However, until now there has been a memory spike at the end of the job when prediction is performed for all indexed reflections. This is now reduced somewhat by not caching derivatives in the reflection table in this case, as we only need them during refinement anyway. (b826caa) (1 message)
[git/dials] master: simpler to use libtbx.python -m pip install <package> (71311a5) (1 message)
[git/dials] master: support for viewing files imported from xds in reciprocal lattice viewer (786c3a7) (1 message)
[git/dials] master: Tidied up import a bit - was previously difficult to see what was going on. Added some code to transform stills to sweeps if oscillation is given. (e6510c8) (1 message)
[git/dials] master: tidying up, improving docstrings etc. after refactoring (d1ff8c2) (1 message)
[git/dials] master: Tool to generate histogram of #spots in resolution shells, scaled as 1/d**2 (6a3e174) (1 message)
[git/dials] master: update multi-lattice tutorial to reflect current best usage (3949ef0) (1 message)
[git/dials] master: Update parallax correction if geometry is updated. Fixes #163 (c098a69) (1 message)
[git/dials] master: use jinja2 templates to create html reports (b7ed590) (1 message)
[git/dials] master: Use new flex.weighted_histogram; gives *identical* results :)@ (dfabf94) (1 message)
[git/dials] master: Use None to signify null derivatives and short circuit calculations involving these (9590380) (1 message)
[git/dials] master: Use sparse storage in Gaussian smoother, where many elts are expected to be 0.0 (51d0733) (1 message)
[git/dials] master: with a little more generic variable naming the loops over parameterisations can be shared between scans and stills type parameterisations and hence moved to the shared base (5cc562f) (1 message)
[git/dials_scratch] master: fix for interface change (178bcca) (1 message)

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[git/dials] master: 1.2.5 released (d3ef762)

[git/dials] master: 1.2.5 released (d3ef762)

DIALS Commit via DLS Jenkins

Thu, 9 Jun 2016 08:47:49 +0100

130 lines

New Thread

[git/dials] master: Add isoform refinement to the stills indexer. (fff3ca5)

[git/dials] master: Add isoform refinement to the stills indexer. (fff3ca5)

DIALS Commit via DLS Jenkins

Mon, 13 Jun 2016 15:56:49 -0700

379 lines

New Thread

[git/dials] master: Add mask=filename to dials.image_viewer for easy viewing of dials mask files. (9828fc8)

[git/dials] master: Add mask=filename to dials.image_viewer for easy viewing of dials mask files. (9828fc8)

DIALS Commit via DLS Jenkins

Tue, 7 Jun 2016 16:32:43 -0700

248 lines

New Thread

[git/dials] master: Add option to only display integrated reflections (630e22c)

[git/dials] master: Add option to only display integrated reflections (630e22c)

DIALS Commit via DLS Jenkins

Fri, 10 Jun 2016 10:57:08 +0100

157 lines

New Thread

[git/dials] master: Add option to only show integration shoeboxes (b09455e)

[git/dials] master: Add option to only show integration shoeboxes (b09455e)

DIALS Commit via DLS Jenkins

Fri, 10 Jun 2016 13:30:52 +0100

190 lines

New Thread

[git/dials] master: Add refinement paper to publications.html (910155c)

[git/dials] master: Add refinement paper to publications.html (910155c)

DIALS Commit via DLS Jenkins

Thu, 9 Jun 2016 15:34:32 +0100

69 lines

New Thread

[git/dials] master: Added gain to spot finding (e6e2c52)

[git/dials] master: Added gain to spot finding (e6e2c52)

DIALS Commit via DLS Jenkins

Fri, 17 Jun 2016 13:26:25 +0100

192 lines

New Thread

[git/dials] master: Allow indexing for data imported from XDS SPOT.XDS (f484810)

[git/dials] master: Allow indexing for data imported from XDS SPOT.XDS (f484810)

DIALS Commit via DLS Jenkins

Wed, 15 Jun 2016 10:11:08 +0100

112 lines

New Thread

[git/dials] master: Allow setting frames; helps with datablock.json (540acf4)

[git/dials] master: Allow setting frames; helps with datablock.json (540acf4)

DIALS Commit via DLS Jenkins

Tue, 14 Jun 2016 08:15:40 +0100

102 lines

New Thread

[git/dials] master: Allow z-min z-max in rlv; fixes #145 (bbe3278)

[git/dials] master: Allow z-min z-max in rlv; fixes #145 (bbe3278)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 11:32:52 +0100

268 lines

New Thread

[git/dials] master: Also changed moslfm to plane here (1d1cdfa)

[git/dials] master: Also changed moslfm to plane here (1d1cdfa)

DIALS Commit via DLS Jenkins

Tue, 28 Jun 2016 13:16:11 +0100

118 lines

New Thread

[git/dials] master: avoid double call of _get_flex_image() on loading of new image (039b3c6)

[git/dials] master: avoid double call of _get_flex_image() on loading of new image (039b3c6)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 16:28:24 +0100

285 lines

New Thread

[git/dials] master: Bug fix (4a24459)

[git/dials] master: Bug fix (4a24459)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 14:37:10 +0100

99 lines

New Thread

[git/dials] master: bug fix for display of unindexed reflections from integrated.pickle (8c39ec3)

[git/dials] master: bug fix for display of unindexed reflections from integrated.pickle (8c39ec3)

DIALS Commit via DLS Jenkins

Tue, 21 Jun 2016 15:05:42 -0500

95 lines

New Thread

[git/dials] master: cache frame number for scan-varying paramterisations to avoid composing more than once (5bfdaa6)

[git/dials] master: cache frame number for scan-varying paramterisations to avoid composing more than once (5bfdaa6)

DIALS Commit via DLS Jenkins

Tue, 28 Jun 2016 14:21:43 +0100

144 lines

New Thread

[git/dials] master: Catch no reflection in input and raise Sorry (fda54e6)

[git/dials] master: Catch no reflection in input and raise Sorry (fda54e6)

DIALS Commit via DLS Jenkins

Tue, 14 Jun 2016 12:05:39 +0100

87 lines

New Thread

[git/dials] master: Changed outlier name from mosflm to plane as suggested by reviewer (f3aab5b)

[git/dials] master: Changed outlier name from mosflm to plane as suggested by reviewer (f3aab5b)

DIALS Commit via DLS Jenkins

Tue, 28 Jun 2016 13:16:11 +0100

132 lines

New Thread

[git/dials] master: Check make exit codes and stop on error (6d0366d)

[git/dials] master: Check make exit codes and stop on error (6d0366d)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 10:31:27 +0100

116 lines

New Thread

[git/dials] master: Clean code some; add summary information; FIXME should re-use resolution array (bf14998)

[git/dials] master: Clean code some; add summary information; FIXME should re-use resolution array (bf14998)

DIALS Commit via DLS Jenkins

Mon, 13 Jun 2016 15:52:03 +0100

242 lines

New Thread

[git/dials] master: consistent use of EOF vs eof in heredocs in documentation (02edfc4)

[git/dials] master: consistent use of EOF vs eof in heredocs in documentation (02edfc4)

DIALS Commit via DLS Jenkins

Fri, 24 Jun 2016 15:30:31 -0500

205 lines

New Thread

[git/dials] master: correction for revision e584ac9 - the method exists in Pillow, it just raises Exception (ed46252)

[git/dials] master: correction for revision e584ac9 - the method exists in Pillow, it just raises Exception (ed46252)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 15:20:47 +0100

128 lines

New Thread

[git/dials] master: defluff installer, fixes #149 (937a231)

[git/dials] master: defluff installer, fixes #149 (937a231)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 10:55:11 +0100

193 lines

New Thread

[git/dials] master: dials.export: change default output name hklout -> integrated (52041f9)

[git/dials] master: dials.export: change default output name hklout -> integrated (52041f9)

DIALS Commit via DLS Jenkins

Fri, 24 Jun 2016 16:08:24 -0500

193 lines

New Thread

[git/dials] master: dials.stills_process: accept json files, not just raw images. Allows using dials.import with overrides like mosflm_beam_center. (68a5094)

[git/dials] master: dials.stills_process: accept json files, not just raw images. Allows using dials.import with overrides like mosflm_beam_center. (68a5094)

DIALS Commit via DLS Jenkins

Wed, 29 Jun 2016 07:51:23 -0700

134 lines

New Thread

[git/dials] master: Did clean cluter (c4a53af)

[git/dials] master: Did clean cluter (c4a53af)

DIALS Commit via DLS Jenkins

Fri, 17 Jun 2016 13:39:52 +0100

48 lines

New Thread

[git/dials] master: Documentation for the distl/dials apache spotfinder server. (13963a7)

[git/dials] master: Documentation for the distl/dials apache spotfinder server. (13963a7)

DIALS Commit via DLS Jenkins

Fri, 10 Jun 2016 09:25:54 -0700

289 lines

New Thread

[git/dials] master: Exclude further directories from installer (b7ad223)

[git/dials] master: Exclude further directories from installer (b7ad223)

DIALS Commit via DLS Jenkins

Thu, 9 Jun 2016 11:17:33 +0100

89 lines

New Thread

[git/dials] master: Expose hard-coded parameters for stills indexing: (3f9c49d)

[git/dials] master: Expose hard-coded parameters for stills indexing: (3f9c49d)

DIALS Commit via DLS Jenkins

Tue, 28 Jun 2016 22:12:48 -0700

148 lines

New Thread

[git/dials] master: Fail test if dials.import fails (d59f9ff)

[git/dials] master: Fail test if dials.import fails (d59f9ff)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 16:57:17 +0100

139 lines

New Thread

[git/dials] master: Feedback from DESY: make workshop proceedings more visible by putting them in their own page, not 'Links'. Move Framework Report to Publications (01bb483)

[git/dials] master: Feedback from DESY: make workshop proceedings more visible by putting them in their own page, not 'Links'. Move Framework Report to Publications (01bb483)

DIALS Commit via DLS Jenkins

Tue, 21 Jun 2016 11:35:30 +0100

296 lines

New Thread

[git/dials] master: fix dials.background (411daeb)

[git/dials] master: fix dials.background (411daeb)

DIALS Commit via DLS Jenkins

Thu, 23 Jun 2016 11:44:37 -0500

97 lines

New Thread

[git/dials] master: fix documentation (ff5cb2e)

[git/dials] master: fix documentation (ff5cb2e)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 12:11:34 +0100

81 lines

New Thread

[git/dials] master: Fix documnentation (a4a89ec)

[git/dials] master: Fix documnentation (a4a89ec)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 11:02:54 +0100

75 lines

New Thread

[git/dials] master: Fix for #155 view predictions in RLV (e8dfddb)

[git/dials] master: Fix for #155 view predictions in RLV (e8dfddb)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 11:37:56 +0100

271 lines

New Thread

[git/dials] master: fix for #156 (62dbb4a)

[git/dials] master: fix for #156 (62dbb4a)

DIALS Commit via DLS Jenkins

Fri, 17 Jun 2016 10:13:49 +0100

84 lines

New Thread

[git/dials] master: Fix ice ring filtering for blank images (f44b64c)

[git/dials] master: Fix ice ring filtering for blank images (f44b64c)

DIALS Commit via DLS Jenkins

Fri, 24 Jun 2016 09:31:10 +0100

126 lines

New Thread

[git/dials] master: Fix indentation of comments (d792fa0)

[git/dials] master: Fix indentation of comments (d792fa0)

DIALS Commit via DLS Jenkins

Fri, 17 Jun 2016 13:44:57 +0100

88 lines

New Thread

[git/dials] master: fix README (1606df6)

[git/dials] master: fix README (1606df6)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 17:23:38 +0100

76 lines

New Thread

[git/dials] master: fix some sphinx warnings (3db12e0)

[git/dials] master: fix some sphinx warnings (3db12e0)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 12:42:15 +0100

288 lines

New Thread

[git/dials] master: Fixed a bug in idials (c0bd4e5)

[git/dials] master: Fixed a bug in idials (c0bd4e5)

DIALS Commit via DLS Jenkins

Wed, 1 Jun 2016 10:14:08 +0100

266 lines

New Thread

[git/dials] master: Fixed bug (7aab8e2)

[git/dials] master: Fixed bug (7aab8e2)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 11:21:13 +0100

78 lines

New Thread

[git/dials] master: Fixed for HDF5 files in multiple jobs and processes. Need to make sure file is closed because of fork behaviour in python multiprocessing. Fixes #144 (b19510e)

[git/dials] master: Fixed for HDF5 files in multiple jobs and processes. Need to make sure file is closed because of fork behaviour in python multiprocessing. Fixes #144 (b19510e)

DIALS Commit via DLS Jenkins

Thu, 2 Jun 2016 15:50:04 +0100

153 lines

New Thread

[git/dials] master: Fixed test (d5670f6)

[git/dials] master: Fixed test (d5670f6)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 16:56:06 +0100

98 lines

New Thread

[git/dials] master: fixes #166 (bug probably introduced by 039b3c679fd5a7c5e5c78fdacc3e9a805cb6d65c) (a04434d)

[git/dials] master: fixes #166 (bug probably introduced by 039b3c679fd5a7c5e5c78fdacc3e9a805cb6d65c) (a04434d)

DIALS Commit via DLS Jenkins

Wed, 29 Jun 2016 10:35:42 +0100

133 lines

New Thread

[git/dials] master: Fixes for plotting integrated experiments and reflections when using multi-panel detector e.g. I23 (518d136)

[git/dials] master: Fixes for plotting integrated experiments and reflections when using multi-panel detector e.g. I23 (518d136)

DIALS Commit via DLS Jenkins

Fri, 10 Jun 2016 09:30:33 +0100

146 lines

New Thread

[git/dials] master: FIXME for single image integration (6e40dc6)

[git/dials] master: FIXME for single image integration (6e40dc6)

DIALS Commit via DLS Jenkins

Thu, 30 Jun 2016 15:46:23 +0100

109 lines

New Thread

[git/dials] master: FIXME; I think yes (7c4ebcd)

[git/dials] master: FIXME; I think yes (7c4ebcd)

DIALS Commit via DLS Jenkins

Fri, 10 Jun 2016 16:08:04 +0100

189 lines

New Thread

[git/dials] master: Follow on from 6d7cd98, also use C++ helper class in scan-varying parameterisations for small but significant time savings (c53f070)

[git/dials] master: Follow on from 6d7cd98, also use C++ helper class in scan-varying parameterisations for small but significant time savings (c53f070)

DIALS Commit via DLS Jenkins

Wed, 29 Jun 2016 12:28:16 +0100

192 lines

New Thread

[git/dials] master: For stills integration, remove reflections with at least one bad foreground pixel. (e73416d)

[git/dials] master: For stills integration, remove reflections with at least one bad foreground pixel. (e73416d)

DIALS Commit via DLS Jenkins

Mon, 13 Jun 2016 11:39:58 -0700

91 lines

New Thread

[git/dials] master: Further to #166: Only update view if any value has changed. Means you can still tab/click through the parameters without freezing (5ca25c9)

[git/dials] master: Further to #166: Only update view if any value has changed. Means you can still tab/click through the parameters without freezing (5ca25c9)

DIALS Commit via DLS Jenkins

Wed, 29 Jun 2016 10:44:08 +0100

101 lines

New Thread

[git/dials] master: image_viewer optimisations when no spots to display (28a845f)

[git/dials] master: image_viewer optimisations when no spots to display (28a845f)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 16:41:35 +0100

160 lines

New Thread

[git/dials] master: Improved error message: although dmin is the variable name, d_min is what the user sees via phil (a7945b3)

[git/dials] master: Improved error message: although dmin is the variable name, d_min is what the user sees via phil (a7945b3)

DIALS Commit via DLS Jenkins

Tue, 28 Jun 2016 11:05:37 +0100

81 lines

New Thread

[git/dials] master: Is this a bug? (4b993a2)

[git/dials] master: Is this a bug? (4b993a2)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 11:12:34 +0100

81 lines

New Thread

[git/dials] master: Key control of view; use up/down/left/right for big moves; shift+same for finer control (0.1*scale); fixes #142 (1b1b82b)

[git/dials] master: Key control of view; use up/down/left/right for big moves; shift+same for finer control (0.1*scale); fixes #142 (1b1b82b)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 10:27:14 +0100

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[git/dials] master: missing print >> out (549568d)

[git/dials] master: missing print >> out (549568d)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 12:11:34 +0100

125 lines

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[git/dials] master: Missing Sorry() imports lead to hilarious tracebacks. (6cc2028)

[git/dials] master: Missing Sorry() imports lead to hilarious tracebacks. (6cc2028)

DIALS Commit via DLS Jenkins

Tue, 21 Jun 2016 09:22:16 +0100

104 lines

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[git/dials] master: more debug output for find_max_cell (d37da74)

[git/dials] master: more debug output for find_max_cell (d37da74)

DIALS Commit via DLS Jenkins

Thu, 23 Jun 2016 14:39:56 +0100

98 lines

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[git/dials] master: more refactoring (07cba11)

[git/dials] master: more refactoring (07cba11)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

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[git/dials] master: more refactoring (14e1c16)

[git/dials] master: more refactoring (14e1c16)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

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[git/dials] master: More sensible caching and return of derivatives for multi-state parameterisations; also clean up dead code (7b3d9ac)

[git/dials] master: More sensible caching and return of derivatives for multi-state parameterisations; also clean up dead code (7b3d9ac)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 16:40:22 +0100

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[git/dials] master: More warnings that should probably be debug (5a4a1fd)

[git/dials] master: More warnings that should probably be debug (5a4a1fd)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 14:46:21 +0100

145 lines

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[git/dials] master: move a shared method to a base class (6e0d1e4)

[git/dials] master: move a shared method to a base class (6e0d1e4)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

272 lines

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[git/dials] master: Move background to dials.background; philling (71005cf)

[git/dials] master: Move background to dials.background; philling (71005cf)

DIALS Commit via DLS Jenkins

Mon, 13 Jun 2016 15:22:56 +0100

349 lines

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[git/dials] master: Move sim_mx data to dials_regression. Update tests. Suggested change for #149 (e012b64)

[git/dials] master: Move sim_mx data to dials_regression. Update tests. Suggested change for #149 (e012b64)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 11:25:22 +0100

80 lines

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[git/dials] master: move workshops page to the correct place; add more links and contact information (b4e6001)

[git/dials] master: move workshops page to the correct place; add more links and contact information (b4e6001)

DIALS Commit via DLS Jenkins

Tue, 21 Jun 2016 12:08:21 +0100

167 lines

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[git/dials] master: Moved controller part of idials to util/idials so it can be incorporated into GUI (c0ea570)

[git/dials] master: Moved controller part of idials to util/idials so it can be incorporated into GUI (c0ea570)

DIALS Commit via DLS Jenkins

Wed, 1 Jun 2016 13:15:55 +0100

63 lines

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[git/dials] master: Moved import of scipy so that it's always before any cctbx modues (90d437a)

[git/dials] master: Moved import of scipy so that it's always before any cctbx modues (90d437a)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 15:17:07 +0100

117 lines

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[git/dials] master: no need to recalculate bin tt values as already calculated by histogram code (27623bd)

[git/dials] master: no need to recalculate bin tt values as already calculated by histogram code (27623bd)

DIALS Commit via DLS Jenkins

Thu, 23 Jun 2016 11:56:39 -0500

100 lines

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[git/dials] master: Now _get_gradients_core is the same in all derived classes, so move it to the base class get_gradients method (84a99bf)

[git/dials] master: Now _get_gradients_core is the same in all derived classes, so move it to the base class get_gradients method (84a99bf)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

460 lines

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[git/dials] master: option to generate plot of background intensity vs resolution (c7a3315)

[git/dials] master: option to generate plot of background intensity vs resolution (c7a3315)

DIALS Commit via DLS Jenkins

Thu, 30 Jun 2016 11:29:13 +0100

176 lines

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[git/dials] master: P1 is a special case (8fce7f0)

[git/dials] master: P1 is a special case (8fce7f0)

DIALS Commit via DLS Jenkins

Fri, 24 Jun 2016 06:50:14 -0500

94 lines

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[git/dials] master: Potential workaround for group frames that have zero distance. @rjgildea Does this work now? (6fcb0cb)

[git/dials] master: Potential workaround for group frames that have zero distance. @rjgildea Does this work now? (6fcb0cb)

DIALS Commit via DLS Jenkins

Tue, 28 Jun 2016 19:02:55 +0100

106 lines

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[git/dials] master: print out auto value of mp_chunksize (c6df3b6)

[git/dials] master: print out auto value of mp_chunksize (c6df3b6)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 10:28:56 +0100

75 lines

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[git/dials] master: print table of bravais lattice to space groups in dials.refine_bravais_settings (0c6f8e7)

[git/dials] master: print table of bravais lattice to space groups in dials.refine_bravais_settings (0c6f8e7)

DIALS Commit via DLS Jenkins

Thu, 23 Jun 2016 22:51:51 -0500

146 lines

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[git/dials] master: Propagate stdout/stderr so that GUI can intercept. Also make running command asynchronous, with mutex locks to ensure that nothing gets messed up. (3930e61)

[git/dials] master: Propagate stdout/stderr so that GUI can intercept. Also make running command asynchronous, with mutex locks to ensure that nothing gets messed up. (3930e61)

DIALS Commit via DLS Jenkins

Thu, 2 Jun 2016 13:41:28 +0100

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[git/dials] master: Putative fix for #107; involves not showing masks if sum_images != 1 (89e0a64)

[git/dials] master: Putative fix for #107; involves not showing masks if sum_images != 1 (89e0a64)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 14:31:47 +0100

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[git/dials] master: refactoring to improve code reusability (a6acda9)

[git/dials] master: refactoring to improve code reusability (a6acda9)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

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[git/dials] master: remove unused parameter (58279c2)

[git/dials] master: remove unused parameter (58279c2)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 12:11:34 +0100

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[git/dials] master: Removed absolute paths in state file. (1d9dee7)

[git/dials] master: Removed absolute paths in state file. (1d9dee7)

DIALS Commit via DLS Jenkins

Wed, 1 Jun 2016 14:11:17 +0100

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[git/dials] master: removing commented and no longer needed test print (e392d98)

[git/dials] master: removing commented and no longer needed test print (e392d98)

DIALS Commit via DLS Jenkins

Wed, 1 Jun 2016 13:50:31 +0100

80 lines

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[git/dials] master: Sanity check: closes #165 (15936e1)

[git/dials] master: Sanity check: closes #165 (15936e1)

DIALS Commit via DLS Jenkins

Tue, 28 Jun 2016 11:03:39 +0100

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[git/dials] master: Say what we are using (08176a5)

[git/dials] master: Say what we are using (08176a5)

DIALS Commit via DLS Jenkins

Fri, 24 Jun 2016 12:23:31 +0100

74 lines

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[git/dials] master: Send to debug instead to suppress excessive number of these warnings appearing in the user log (c29c10e)

[git/dials] master: Send to debug instead to suppress excessive number of these warnings appearing in the user log (c29c10e)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 13:58:44 +0100

92 lines

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[git/dials] master: Set chunksize to auto; fixes #150 (5cbe9ac)

[git/dials] master: Set chunksize to auto; fixes #150 (5cbe9ac)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 08:27:38 +0100

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[git/dials] master: Setting reflections_per_degree may be beneficial for large scan-varying refinement jobs to reduce memory use. However, until now there has been a memory spike at the end of the job when prediction is performed for all indexed reflections. This is now reduced somewhat by not caching derivatives in the reflection table in this case, as we only need them during refinement anyway. (b826caa)

[git/dials] master: Setting reflections_per_degree may be beneficial for large scan-varying refinement jobs to reduce memory use. However, until now there has been a memory spike at the end of the job when prediction is performed for all indexed reflections. This is now reduced somewhat by not caching derivatives in the reflection table in this case, as we only need them during refinement anyway. (b826caa)

DIALS Commit via DLS Jenkins

Tue, 28 Jun 2016 15:56:58 +0100

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[git/dials] master: simpler to use libtbx.python -m pip install <package> (71311a5)

[git/dials] master: simpler to use libtbx.python -m pip install (71311a5)

DIALS Commit via DLS Jenkins

Wed, 8 Jun 2016 09:46:14 +0100

103 lines

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[git/dials] master: support for viewing files imported from xds in reciprocal lattice viewer (786c3a7)

[git/dials] master: support for viewing files imported from xds in reciprocal lattice viewer (786c3a7)

DIALS Commit via DLS Jenkins

Fri, 24 Jun 2016 10:18:03 -0500

139 lines

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[git/dials] master: Tidied up import a bit - was previously difficult to see what was going on. Added some code to transform stills to sweeps if oscillation is given. (e6510c8)

[git/dials] master: Tidied up import a bit - was previously difficult to see what was going on. Added some code to transform stills to sweeps if oscillation is given. (e6510c8)

DIALS Commit via DLS Jenkins

Thu, 9 Jun 2016 17:09:18 +0100

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[git/dials] master: tidying up, improving docstrings etc. after refactoring (d1ff8c2)

[git/dials] master: tidying up, improving docstrings etc. after refactoring (d1ff8c2)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

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[git/dials] master: Tool to generate histogram of #spots in resolution shells, scaled as 1/d**2 (6a3e174)

[git/dials] master: Tool to generate histogram of #spots in resolution shells, scaled as 1/d**2 (6a3e174)

DIALS Commit via DLS Jenkins

Fri, 17 Jun 2016 13:51:11 +0100

251 lines

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[git/dials] master: update multi-lattice tutorial to reflect current best usage (3949ef0)

[git/dials] master: update multi-lattice tutorial to reflect current best usage (3949ef0)

DIALS Commit via DLS Jenkins

Thu, 23 Jun 2016 22:55:39 -0500

169 lines

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[git/dials] master: Update parallax correction if geometry is updated. Fixes #163 (c098a69)

[git/dials] master: Update parallax correction if geometry is updated. Fixes #163 (c098a69)

DIALS Commit via DLS Jenkins

Mon, 27 Jun 2016 11:58:29 +0100

176 lines

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[git/dials] master: use jinja2 templates to create html reports (b7ed590)

[git/dials] master: use jinja2 templates to create html reports (b7ed590)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 17:06:05 +0100

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[git/dials] master: Use new flex.weighted_histogram; gives *identical* results :)@ (dfabf94)

[git/dials] master: Use new flex.weighted_histogram; gives *identical* results :)@ (dfabf94)

DIALS Commit via DLS Jenkins

Tue, 14 Jun 2016 09:20:16 +0100

155 lines

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[git/dials] master: Use None to signify null derivatives and short circuit calculations involving these (9590380)

[git/dials] master: Use None to signify null derivatives and short circuit calculations involving these (9590380)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

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[git/dials] master: Use sparse storage in Gaussian smoother, where many elts are expected to be 0.0 (51d0733)

[git/dials] master: Use sparse storage in Gaussian smoother, where many elts are expected to be 0.0 (51d0733)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

299 lines

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[git/dials] master: with a little more generic variable naming the loops over parameterisations can be shared between scans and stills type parameterisations and hence moved to the shared base (5cc562f)

[git/dials] master: with a little more generic variable naming the loops over parameterisations can be shared between scans and stills type parameterisations and hence moved to the shared base (5cc562f)

DIALS Commit via DLS Jenkins

Fri, 3 Jun 2016 15:26:48 +0100

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[git/dials_scratch] master: fix for interface change (178bcca)

[git/dials_scratch] master: fix for interface change (178bcca)

DIALS Scratch Commit via DLS Jenkins

Fri, 3 Jun 2016 15:50:06 +0100

91 lines

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