[phenixbb] phenix.get_cc_mtz_pdb but allow for atom selections.

Pavel Afonine pafonine at lbl.gov
Sat Mar 3 08:27:57 PST 2012


Hi Francis,

phenix.real_space_correlation

allows to compute correlations between nearly any user-defined maps, can 
use x-ray or neutron scattering dictionaries, accepts atoms selections, 
detail level (cc per residue, atom etc).

I don't remember if it is available in the GUI (Nat to confirm), if not 
then it would be good to have.

Pavel


On 3/3/12 8:05 AM, Francis E Reyes wrote:
> It'd be wonderful to pass in an atom selection (say backbone, or ligand or what have you) into phenix.get_cc_mtz_pdb . Is this functionality available in some other phenix util?
>
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> Thanks!
> F
>
>
>
> ---------------------------------------------
> Francis E. Reyes M.Sc.
> 215 UCB
> University of Colorado at Boulder
>
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>
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>
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