[phenixbb] hi
Ralf W. Grosse-Kunstleve
rwgk at cci.lbl.gov
Tue Jul 6 05:49:39 PDT 2010
> From the phenix manual:
>
> Refinement with minimization (selected part of model):
> % phenix.refine data.hkl model.pdb strategy=individual_sites
> sites.individual="chain A"
>
> This will refine the coordinates of atoms in chain A while keeping fixed
> the atomic coordinates in chain B.
We have a pretty general atom selection syntax which lets you select
for example
sites.individual="resid 10:20"
in case the moving and the fixed part have the same chain id.
See the "Atom selection examples" in the phenix.refine docs.
Ralf
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