Owner

dkratzert

5 indexed repositories · View on GitHub

• FinalCif

  A CIF file finalizer for small molecule crystallography with as much automation as possible.

  Python · 22 stars

• StructureFinder

  A crystal structure finder written in PyQt5 and Python3

  Python · 15 stars

• ShelXFile

  A parser and editor for SHELXL files.

  Python · 15 stars

• DSR

  Refinement of disordered structures with SHELXL

  Python · 5 stars

• FragmentDB

  A port of DSR to Olex2

  Python · 1 star