Age | Commit message (Collapse) | Author | |
---|---|---|---|
2023-07-28 | Fix incorrect sign of clen gradient | Thomas White | |
2021-07-21 | do_integral: Remove unnecessary assignments | Thomas White | |
These local variables were being assigned just before returning. | |||
2021-07-21 | safe_khalf: Use NAN instead of 0.0/0.0 | Thomas White | |
2021-07-21 | Fix random_partiality() | Thomas White | |
2021-04-27 | Rename libcrystfel's config.h to libcrystfel-config.h | Thomas White | |
This removes the big potential for confusion, which has happened several times (see e.g. 095cbebaf6). It also fixes in-tree builds with CMake (but seriously, always use out-of-tree builds). Fixes #2. | |||
2021-03-23 | Use crystal's detector shift during prediction | Thomas White | |
Previously, this was handled by updating the detector, but this could easily lead to strange double accounting. | |||
2021-03-05 | Mass update of copyright dates in source code comments | Thomas White | |
2021-01-08 | locate_peak_on_panel: Check sign of 1/mu | Thomas White | |
2020-09-24 | Fix old warning message | Thomas White | |
2020-07-29 | Replace largest_q for detgeom | Thomas White | |
2020-07-29 | Remove more references to old detector structure | Thomas White | |
2020-07-29 | Convert prediction gradients to detgeom | Thomas White | |
2020-07-29 | Convert prediction and integration to detgeom | Thomas White | |
2020-01-10 | Mass update of copyright dates | Thomas White | |
2019-11-15 | Add partiality model GGPM | Wolfgang Brehm | |
2019-11-05 | bug fix in Ewald sphere width calculation | Yaroslav Gevorkov | |
2019-10-24 | polarisation_correction: Use symmetric indices | Thomas White | |
2019-10-24 | polarisation_correction: Scale the sigma as well | Thomas White | |
2019-09-12 | Fix sign of zl comparison | Thomas White | |
2019-09-12 | Fix possibly uninitialised overlap_integral | Thomas White | |
Introduced by b6af09d78d49d552a05b81bd20a7854a180373f5 | |||
2019-09-05 | Allow the polarsation correction to be completely disabled | Thomas White | |
2019-09-02 | Don't need separate wavelength for polarisation correction | Thomas White | |
Can use kpred | |||
2019-09-02 | process_hkl,partialator: Allow arbitrary direction and degree of polarisation | Thomas White | |
2019-08-26 | Formatting/fussiness | Thomas White | |
2019-08-26 | loop prediction for gaussian sum spectrum | Wolfgang Brehm | |
2019-07-17 | partialator: Add "offset" model (Ewald sphere offset assuming monochromatic ↵ | Thomas White | |
beam) | |||
2019-07-17 | partialator: Use Spectrum API | Thomas White | |
2019-05-07 | Update all source code comments to Doxygen format | Thomas White | |
2018-02-27 | Replace debugging code with an assert() | Thomas White | |
2018-02-27 | Halve the bandwidth | Thomas White | |
2018-02-27 | Take modulus of profile radius | Thomas White | |
A bit nasty, but avoids lots of NANs | |||
2018-02-27 | Set integral range to +/- 3 sigma | Thomas White | |
2018-02-27 | Add an assertion | Thomas White | |
2018-02-27 | do_integral(): Take part of the filename as input for debug | Thomas White | |
2018-02-27 | Horrible restraint to keep algorithm from drifting too far | Thomas White | |
2018-02-27 | Minimisation fixes | Thomas White | |
2018-02-27 | Minimisation debug stuff | Thomas White | |
2018-02-27 | Remove old code (and formatting) | Thomas White | |
2018-02-27 | New clamping criteria | Thomas White | |
2018-02-27 | Record khalf for reflections | Thomas White | |
2018-02-27 | New partiality model from Ginn et al. | Thomas White | |
2018-02-27 | Separate partiality calculation from prediction | Thomas White | |
2016-12-09 | New polarisation correction | Thomas White | |
2016-11-10 | Fix 2theta calculation in locate_peak_on_panel() | Thomas White | |
The "improved" version of this, added by 9b1374999 along with the new spot position calculation for out-of-plane panels, actually assumes that the reflection is at the exact Bragg condition. This is not a valid assumption here. The difference is small (<0.5 px), but made the prediction refinement gradients completely wrong. | |||
2016-07-29 | Use z components in prediction | Thomas White | |
2016-07-01 | No more slab-relative coordinates in libcrystfel | Thomas White | |
2016-02-29 | Don't predict 000 | Thomas White | |
2015-08-14 | Improve random partiality model | Thomas White | |
2015-07-21 | Add random partiality model | Thomas White | |
2015-07-21 | Update API docs | Thomas White | |