12 Aug
2010
12 Aug
'10
5:03 p.m.
On a different but related note, is there some way to print out the list of bond length deviations from ideal values for all the restrained bonds in the structure?
Each time phenix.refine starts up it writes these to the .geo file (unless you set write_geo_file=False), "Sorted by residual". You can also set write_final_geo_file=True to get the sorted restraints after refinement. Ralf