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2013-11-24tests/integration_check: Reduce number of trials to 300Thomas White
2013-11-24prof2d_check: Test sigmas of weak and strong reflectionsThomas White
2013-11-24FormattingThomas White
2013-11-24Add tests/prof2d_checkThomas White
2013-11-23indexamajig: Add --int-diagThomas White
2013-11-23Add Histogram, and plot integration test resultsThomas White
2013-11-23Run the test 1,000 timesThomas White
2013-11-23Increase peak integration radiusThomas White
2013-11-23Make tests/integration_check workThomas White
2013-11-23Break off integrate_rings_once()Thomas White
2013-09-13Add tests/pr_pl_gradient_check for testing gradient of total correction factorsThomas White
2013-09-13Fix incorrect handling of monoclinic C cellsThomas White
2013-08-01Add test for gradient of Lorentz factor (as well as partiality)Thomas White
2013-07-25partialator: Account for Lorentz factorThomas White
2013-07-24Iteration over reflection list should include other reflections with same ↵Thomas White
asymmetric indices This fixes a >2 year old bug in the reflection list, and a bug in tests/list_check.c which allowed it to go undetected for so long. The main situation where it would have caused problems is when asymmetric_indices() was called on a reflection list containing symmetrically equivalent reflections. The only core CrystFEL program which does this is partialator. compare_hkl uses asymmetric_indices(), but the reflections are already guaranteed to be asymmetric by that point (because check_list_symmetry() has been called).
2013-07-04tests/partialator_merge_check_*: Remove scaling-report.pdf afterwardsThomas White
2013-04-30Add new testsThomas White
2013-04-30Fix partialator_merge_check_1Thomas White
2013-04-17Add tests/partialator_merge_check_1Thomas White
2013-04-17tests/pr_gradient_check: Fix criterionThomas White
2013-04-17tests/pr_gradient_check: Add --plotThomas White
2013-04-17pr_gradient_check: Add --quiet, tidy upThomas White
2013-04-17pr_gradient_check: Improved checkingThomas White
2013-04-17pr_gradient_check: Make sure list index keeps step with reflection listThomas White
2013-04-17Add script to plot gradientsThomas White
2013-04-17Group x, y and z gradients togetherThomas White
2013-04-17Work on post refinementThomas White
Brought across from "tom/pr" Conflicts: src/indexamajig.c src/post-refinement.c tests/pr_gradient_check.c
2013-04-17pr_gradient_check: Look for correlations, not individual valuesThomas White
2013-04-17pr_gradient_check: Fix and improveThomas White
2013-04-17Add the possibility to have different partiality modelsThomas White
2013-04-16Remove "use_saturated" argument to integrate_peak()Thomas White
There are no side-effects to setting it either way, and the caller can just set saturated=NULL or ignore the result.
2013-03-05Update copyright datesThomas White
2013-03-05pr_gradient_check: Final fixesThomas White
2013-03-05tests/pr_gradient_check: Fix memory bugsThomas White
2013-02-15Update merge tests for new stream formatThomas White
2013-02-06StuffThomas White
2013-02-05WIP on updating partialatorThomas White
2012-10-21indexamajig: Record number of saturated reflections in streamThomas White
2012-10-19Update .gitignoreThomas White
2012-10-12Add missing fileThomas White
2012-10-11Add some more testsThomas White
2012-10-11Tie off loose endsThomas White
This whole idea is rubbish. There's no way to communicate the setting information via the H-M spacegroup symbol in this way, except in a few circumstances. See ITA (2005) section 4.3. This simplifies matters a lot. There's no need for any extra parsing, because the "_uaX" system is sufficient, and is the best that can be done without inventing a whole new system for point group symbols.
2012-10-10Handle weird unique axis variants of all point groupsThomas White
2012-10-02Finishing tweaks for uncentering stuffThomas White
Today, I have mostly been having my life made difficult by the PDB's invention of "H centering".
2012-10-02Finish transformation_checkThomas White
2012-10-02Ignore new testThomas White
2012-10-02More work on transformationsThomas White
2012-10-02WIPThomas White
2012-10-02WIP on cell transformationsThomas White
2012-10-02Add tests/centering_checkThomas White
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