[phenixbb] can phenix.refine create a diff of the current input file with the pdb from the last run before refining?
Francis E Reyes
Francis.Reyes at Colorado.EDU
Wed Apr 21 10:17:26 PDT 2010
Ralf
Thanks for the advice. I admit the request should go to the bottom of
any priority list.
F
On Apr 21, 2010, at 11:08 AM, Ralf W. Grosse-Kunstleve wrote:
> 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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---------------------------------------------
Francis Reyes M.Sc.
215 UCB
University of Colorado at Boulder
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