Dear Phenix Users, Is it possible to use NCS restraints in DEN refinement like we can do in regular phenix.refine refinement? Thank you for your help. Cheers, Scott ************************************************ Scott T. R. Walsh, PhD Assistant Professor University of Maryland IBBR/CBMG 3127E CARB-2 9600 Gudelsky Drive Rockville, MD 20850 USA phone: (240) 314-6478 fax: (240) 314-6225 email: [email protected]mailto:[email protected]
Hi Scott,
Yes, NCS restraints will work when running DEN refinement. Note, however,
that this is an added restraint on top of the DEN restraints themselves,
and does not apply directly to the DEN restraints, meaning that the DEN
network is not chosen with NCS in mind, and the deformation of these
restraints does not take NCS into account.
Jeff
On Thu, Dec 5, 2013 at 10:20 AM, Scott Thomas Walsh
Dear Phenix Users,
Is it possible to use NCS restraints in DEN refinement like we can do in regular phenix.refine refinement?
Thank you for your help.
Cheers,
Scott
************************************************ Scott T. R. Walsh, PhD Assistant Professor University of Maryland IBBR/CBMG 3127E CARB-2 9600 Gudelsky Drive Rockville, MD 20850 USA phone: (240) 314-6478 fax: (240) 314-6225 email: [email protected]
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participants (2)
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Jeff Headd
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Scott Thomas Walsh