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dkratzert / FinalCif

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

Home Page:https://dkratzert.de/finalcif.html

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Save a diff to the original CIF

dkratzert opened this issue · comments

commented

FinalCif should save a diff to the original CIF in the work directory in order to keep the changes made by the user.
How to select which changes to keep? We don't want to keep atom parameters for example.

  • Probably only changes edited by templates?
  • Or should I add checkbox to the text temlates where you can activate "keep this thing"?
commented
  • Add save of changed loops