XDSSTAT is a home-brewn program that prints various statistics in the form of tables and images, that are not available from XDS itself.
statistics (R-factors, misfits, unique reflections, correlation ...) for each frame
The following quantities mapped onto the detector surface:
- misfits.pck: outliers identified in CORRECT. Useful to identify ice rings.
- rf.pck: R-factor
- anom.pck: anomalous signal
- nobs.pck: observed reflections (not very interesting)
- rlps.pck: reciprocal lorentz factor (not very interesting)
These images are in the .pck format and may be visualized by VIEW.
For now please send email to Kay dot Diederichs at uni-konstanz dot de. The binary program will soon be put on my webpages.
The source code is in Fortran90 and requires a Fortran90-compiled CCP4 library, so few people are currently in a position to compile and link the program. I might opensource it someday, but preferably as part of the XDS distribution.