Age | Commit message (Collapse) | Author | |
---|---|---|---|
2019-03-11 | Tidy up cell comparison | Thomas White | |
2019-03-11 | Keep track of the "un-centering" matrix, as well as the "centering" | Thomas White | |
This makes it easy to reverse the transformation, if required, which it is when comparing centered cells. | |||
2019-03-11 | New way of doing cell comparisons, similar to match_cell() | Thomas White | |
2019-03-11 | Fix tolerances (again) | Thomas White | |
2019-03-11 | Be clear about whether functions need rational or integer transformations | Thomas White | |
2019-03-11 | Use IntegerMatrix for all unit cell transformations | Thomas White | |
Get rid of UnitCellTransformation, a thin wrapper which didn't do anything. | |||
2019-03-11 | Simplify the output of cell_print() | Thomas White | |
2019-03-11 | Change horribly confusing names of unit cell comparison functions | Thomas White | |
cells_are_similar -> compare_cell_parameters_and_orientation compare_cells -> compare_reindexed_cell_parameters_and_orientation cell_tool.c:cells_the_same -> cellutils.c:compare_cell_parameters All comparisons now done in real space, checking that centering is the same, and without uncentering anything. | |||
2019-03-11 | Remove cells_are_similar() from API | Thomas White | |
There are two functions with this name. Avoid confusion. | |||
2019-03-11 | cell_tool: Use libcrystfel cells_are_similar() function | Thomas White | |
2018-11-02 | Change a couple of important asserts to if statements | Thomas White | |
2017-09-22 | Don't write cell parameters to the stream if we don't have them | Thomas White | |
2017-09-07 | Add compare_cells() (and use it in whirligig) | Thomas White | |
2017-07-06 | Merge branch 'master' into taketwo | Thomas White | |
2017-03-10 | cell_print(): Show reciprocal angles | Thomas White | |
2017-01-17 | Removed all debug messages, nice and clean. | Helen Ginn | |
2016-10-25 | TEMPORARY horrible debugging stuff | Thomas White | |
2016-10-19 | Add transform_cell_gsl() | Thomas White | |
2015-11-27 | indexamajig: Write target unit cell into stream | Thomas White | |
2015-06-25 | Tidy up some small leaks and memory bugs | Thomas White | |
2015-06-24 | Whitespace | Thomas White | |
2015-06-18 | Merge branch 'tolstikova/dirax' | Thomas White | |
Conflicts: libcrystfel/src/index.h | |||
2015-06-09 | match_cell(): Tidy up error handling when given a bogus lattice type | Thomas White | |
2015-03-04 | Avoid segfault if cell can't be loaded | Thomas White | |
2015-02-16 | Update API docs | Thomas White | |
2015-02-11 | Move cell_get_volume from asdf.c to cell_utils.c | Alexandra Tolstikova | |
2014-11-26 | Read unique axis from unit cell (.cell) files | Thomas White | |
... and fix the MOSFLM logic again. | |||
2014-11-13 | Fixed parsing of CRYST1 | Takanori Nakane | |
2014-09-19 | Remove cell_{get,set}_pointgroup() from API | Thomas White | |
2014-09-19 | Introduce CrystFEL unit cell files | Thomas White | |
2014-09-02 | cell_print(): Use Angstroms instead of nm | Thomas White | |
2013-09-13 | Fix incorrect handling of monoclinic C cells | Thomas White | |
2013-06-01 | Fix multiple small memory leaks | Thomas White | |
2013-04-18 | Read/write lattice type, centering and unique axis information from/to stream | Thomas White | |
2013-04-18 | Fix small memory leak | Thomas White | |
2013-03-01 | Capitalise all warnings | Thomas White | |
2013-02-09 | uncenter_cell: Free transformation if it's not needed by the caller | Thomas White | |
2012-10-20 | Not actually deprecated (yet) | Thomas White | |
2012-10-20 | Update documentation | Thomas White | |
2012-10-02 | Fix obvious bug | Thomas White | |
2012-10-02 | Fix segfault on failed indexing | Thomas White | |
2012-10-02 | Remove debugging message | Thomas White | |
2012-10-02 | Finishing tweaks for uncentering stuff | Thomas White | |
Today, I have mostly been having my life made difficult by the PDB's invention of "H centering". | |||
2012-10-02 | Formatting | Thomas White | |
2012-10-02 | More work on transformations | Thomas White | |
2012-10-02 | WIP | Thomas White | |
2012-10-02 | WIP | Thomas White | |
2012-10-02 | WIP | Thomas White | |
2012-10-02 | WIP on cell transformations | Thomas White | |
2012-10-02 | Uncenter the cell before using it for indexing stuff | Thomas White | |