[phenixbb] can phenix.refine create a diff of the current input file with the pdb from the last run before refining?

Ralf W. Grosse-Kunstleve rwgk at cci.lbl.gov
Wed Apr 21 10:08:00 PDT 2010


Hi Francois,

It is a bit more work we have time for right now. But if I understand
you correctly this would almost be the same:

  cp model_001.pdb model_001.pdb_as_refined
  edit model_001.pdb
  phenix.refine model_002.def
  # ... doesn't go well
  cp model_001.pdb_as_refined model_001.pdb

I.e. just make a backup of model_001.pdb before you modify it.

Ralf



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