Age | Commit message (Collapse) | Author | |
---|---|---|---|
2020-02-04 | Handle CRLF line terminators in geometry files | Thomas White | |
This was broken by d62367db8fee57, which was some enabling work for reading geometry info from streams. | |||
2020-01-10 | Mass update of copyright dates | Thomas White | |
2019-12-13 | pair_peaks: Don't attempt to pair 000 | Thomas White | |
Normally the beam centre is masked out or not on the detector. However, when it is, pairing with 000 causes gradients to come out as NaN and the prediction refinement to fail. | |||
2019-11-18 | PinkIndexer documentation | Yaroslav Gevorkov | |
2019-11-15 | Add partiality model GGPM | Wolfgang Brehm | |
2019-11-13 | fix long variable names in argp_option | Yaroslav Gevorkov | |
2019-11-13 | rename "overriden" to "custom" | Yaroslav Gevorkov | |
2019-11-13 | catch input error | Yaroslav Gevorkov | |
2019-11-13 | add option --pinkIndexer-override-visible-energy-range | Yaroslav Gevorkov | |
2019-11-13 | Fix peak check logic for multiple crystals | Thomas White | |
It seems that the code wasn't properly updated when multi-crystal indexing was introducted. This "continue" statement didn't do anything. | |||
2019-11-05 | bug fix for standard bandwidth in pinkIndexer | Yaroslav Gevorkov | |
2019-11-05 | bug fix in Ewald sphere width calculation | Yaroslav Gevorkov | |
2019-10-29 | add "override" beam options to pinkIndexer | Yaroslav Gevorkov | |
2019-10-24 | polarisation_correction: Use symmetric indices | Thomas White | |
2019-10-24 | polarisation_correction: Scale the sigma as well | Thomas White | |
2019-10-22 | xds: Fix handedness of unit cell | Thomas White | |
Previously, it was wired to give left handed cells. | |||
2019-10-22 | Add more warnings | Thomas White | |
2019-10-22 | Add some warnings and assertions | Thomas White | |
2019-10-22 | reduce_g6: Fix sign criterion for step 3 | Thomas White | |
2019-10-11 | Copy target cell's lattice type and unique axis into cell from indexing, ↵ | Thomas White | |
after comparison | |||
2019-09-26 | Restore CMake stuff for PinkIndexer | Thomas White | |
See 3fe28041e where it was temporarily removed. | |||
2019-09-23 | Get rid of "rescut" integration flag | Thomas White | |
Its behaviour is 100% covered by the push-res parameter, which can be set to infinity for no cutoff. | |||
2019-09-23 | Remove private option structures from iargs | Thomas White | |
2019-09-23 | Merge branch 'tom/pinkindexer' | Thomas White | |
2019-09-20 | Delegate option processing for indexing methods | Thomas White | |
Involves switching from getopt_long to argp. A big improvement! | |||
2019-09-17 | Add warning if reflections could not be integrated (e.g. due to overlap) | Thomas White | |
2019-09-16 | Fix cell comparison logic | Thomas White | |
2019-09-13 | Remove unused checks | Thomas White | |
Add them back in when they're actually used, of course | |||
2019-09-12 | Fix sign of zl comparison | Thomas White | |
2019-09-12 | Restore default bandwidth (if not specified in geometry file) | Thomas White | |
2019-09-12 | Fix logic | Thomas White | |
2019-09-12 | Force --no-check-peaks and --no-refine if pinkIndexer is used, and add a warning | Thomas White | |
2019-09-12 | Increase indexing timeout when using pinkIndexer | Thomas White | |
2019-09-12 | Add indexing_methods() to examine the actual list of methods | Thomas White | |
2019-09-12 | Remove message directing to old option | Thomas White | |
2019-09-12 | Avoid duplication of beam and detector parameters for pinkIndexer | Thomas White | |
2019-09-12 | bug fix: asking for detector distance != 0 instad of beamBandwidth != 0 | Yaroslav Gevorkov | |
2019-09-12 | pinkIndexer: Remove debugging messages | Thomas White | |
2019-09-12 | Accept --indexing=pinkindexer (lower case) | Thomas White | |
2019-09-12 | Set task name for PinkIndexer | Thomas White | |
2019-09-12 | Add GPL boilerplate | Thomas White | |
2019-09-12 | Whitespace | Thomas White | |
2019-09-12 | Add pinkIndexer interface | Yaroslav Gevorkov | |
2019-09-12 | Fix possibly uninitialised overlap_integral | Thomas White | |
Introduced by b6af09d78d49d552a05b81bd20a7854a180373f5 | |||
2019-09-12 | Fix possibly uninitialised CiAMCB | Thomas White | |
2019-09-10 | sort_peaks(): Handle NULL peak list | Thomas White | |
2019-09-06 | Use new peak check only when doing multi-lattice indexing | Thomas White | |
2019-09-06 | New check for indexing solutions (copied across from pinkIndexer) | Thomas White | |
2019-09-05 | Allow the polarsation correction to be completely disabled | Thomas White | |
2019-09-03 | Fix memory leaks in cell comparison | Thomas White | |