Hi Pavel,
Thank you, I will look into your suggestions.
*I am confused by omega_esd_override_value *
*What is it supposed to do? *
Why? Again curiosity of what phenix.real_space_refine can do. I am trying
to stretch it to the max and see where is breaks….
Thank you
On Wed, Jul 30, 2014 at 12:23 PM, Pavel Afonine
George,
perhaps you can use reference model restraints machinery to do this..? Or perhaps you can tweak corresponding values in mon_lib/list/mon_lib_list.cif file..? Both ways may not be exactly what you want but may offer a reasonable work-around.
Why you would like to do this?
Pavel
On 7/30/14, 11:53 AM, George Devaniranjan wrote:
Hi
I was wondering if there is a way to restrain the omega angles of the structure being refined to its starting values while allowing the phi and psi dihedral angles to vary?
I was looking at
omega_esd_override_value
discard_omega
in phenix.real_space_refine.
Thank you, George
_______________________________________________ phenixbb mailing [email protected]http://phenix-online.org/mailman/listinfo/phenixbb