Age | Commit message (Collapse) | Author | |
---|---|---|---|
2010-02-22 | Tidy some things up: | Thomas White | |
s convention detector geometry comments, help messages | |||
2010-02-05 | Tidy up abort()s | Thomas White | |
... to avoid the special hell reserved for programmers who do this kind of thing. | |||
2010-02-03 | Remove many debug messages | Thomas White | |
2010-01-26 | Slightly more helpful warning message | Thomas White | |
2010-01-22 | Move scattering factors to a common location | Thomas White | |
2010-01-15 | Update copyright dates | Thomas White | |
2010-01-15 | File handling fixes | Thomas White | |
2009-12-16 | Update boilerplate comments | Thomas White | |
2009-11-27 | Macros for status and error messages | Thomas White | |
2009-11-26 | Remove a huge bottleneck in the scattering factor calculation | Thomas White | |
2009-11-26 | Whitespace | Thomas White | |
2009-11-25 | Improve progress bar | Thomas White | |
2009-11-25 | Neaten molecule shift mugwatch | Thomas White | |
2009-11-25 | Introduce integr_sim | Thomas White | |
2009-11-25 | Make Debye-Waller parameter optional | Thomas White | |
2009-11-25 | Whitespace | Thomas White | |
2009-11-25 | Make cache for f1f2 work | Thomas White | |
2009-11-25 | Progress bar improvements and tidy-up | Thomas White | |
2009-11-24 | Tidy up, fix things | Thomas White | |
2009-11-24 | Comments | Thomas White | |
2009-11-24 | Only calculate molecular transform at Bragg positions | Thomas White | |
2009-11-23 | Centre the molecule before calculating structure factors | Thomas White | |
Also fixes an incorrect comment | |||
2009-11-23 | Whitespace | Thomas White | |
2009-11-19 | Make molecular transform work | Thomas White | |
2009-11-19 | Tidy up floating-point precision | Thomas White | |
2009-11-19 | Nicer species table layout | Thomas White | |
2009-11-17 | Add memoization to scattering factor calculation | Thomas White | |
2009-11-17 | Move load_molecule to sfac | Thomas White | |
2009-11-17 | Move scattering factor stuff to new file | Thomas White | |