Age | Commit message (Collapse) | Author | |
---|---|---|---|
2018-02-27 | Replace debugging code with an assert() | Thomas White | |
2018-02-27 | Update comment to clarify interpretation of bandwidth | 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 | Split out setup of minimiser | 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 | Refine wavelength and make algorithm independent of scale | 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 | New no-gradients minimiser for post-refinement | 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 | Read debug indexing from file | Thomas White | |
2018-02-27 | indexamajig: Add --overpredict | Thomas White | |
2018-02-27 | Separate partiality calculation from prediction | Thomas White | |
2018-02-27 | Add const versions of RefList iteration | Thomas White | |
2018-02-27 | More const-cleaning | Thomas White | |
2018-02-27 | const-cleanliness | Thomas White | |
2018-02-08 | Formatting | Thomas White | |
2018-02-08 | Changed the naming of felix options and variables to make them more obvious. | Kenneth R. Beyerlein | |
2018-02-08 | Change Felix min-uniqueness paramter name to max-uniqueness. | Kenneth R. Beyerlein | |
2018-02-08 | Add Felix option felix-max-inter-angle | Kenneth R. Beyerlein | |
2018-02-08 | Make felix-domega option | Kenneth R. Beyerlein | |
2018-01-19 | xds: Remove debug | Thomas White | |
2018-01-19 | Clean up indexing method probes | Thomas White | |
2017-11-28 | Fix check for cell parameters at start | Thomas White | |
2017-11-23 | Avoid truncation with snprintf | Thomas White | |
Just something that came from new compiler warnings after upgrading my system. | |||
2017-11-23 | Fix wrong assertion | Thomas White | |
Whoops. | |||
2017-10-27 | Merge branch 'tom/simpler_felix' | Thomas White | |
2017-10-23 | Check return values from fread/fgets | Thomas White | |
2017-10-19 | Add read_reflections_2() to API | Thomas White | |
New version for reading the symmetry as well | |||
2017-10-19 | Remove read_reflections_from_file() from API | Thomas White | |
See c0ce8fb4 for the rationale behind this. | |||
2017-10-19 | Add probe for TakeTwo | Thomas White | |
2017-10-18 | Check that dirax,felix,mosflm or xds are available at the start | Thomas White | |
Avoids a confusing error message later. | |||
2017-10-18 | indexamajig: Auto-detection of available indexing methods | Thomas White | |
2017-10-18 | Add probe functions to indexing methods | Thomas White | |
2017-10-17 | Handle old indexing methods | Thomas White | |
There are limits to how well they can be handled, but this avoids screwing users over too much. | |||
2017-10-17 | felix: Set nsigmas=1 | Thomas White | |
2017-10-12 | indexamajig: Simplify Felix options | Thomas White | |
2017-10-12 | Remove write_reflections_to_file() from API | Thomas White | |
It's there because it used to be used to write the reflections into the stream. Therefore there was a need for a function to write a bare list of reflections to a file, with no headers. Since then, the stream and merged reflection file formats have diverged, so there's no use for this other than to confuse people. | |||
2017-10-09 | indexer_str(): Don't return "none-nolatt-nocell" | Thomas White | |
2017-10-02 | Formatting fussiness | Thomas White | |
2017-09-27 | remove_flagged_crystals(): Remove multiple bad crystals | Thomas White | |
A silly bug | |||
2017-09-27 | Add an assertion | Thomas White | |
2017-09-27 | Don't reset user flag to zero | Thomas White | |
Some indexing methods may set it to 1 already, in which case we should take the hint. |