14 Sep
2009
14 Sep
'09
5:22 p.m.
Hi Jon, phenix.refine has NCS restraints, which you can make as strong as you like by playing with corresponding weights. phenix.refine does not have NCS constraints, which is: - I realize extremely important for refinement of virus structures. - not the same as "very strict" NCS restrains (although I believe it may be very close). Implementing NCS constraints it's *not *in my to-do list.. May be Ralf can comment some more. We probably need to discuss this internally to decide who and when will do it. Pavel. On 9/14/09 7:03 AM, Jonathan Grimes wrote:
Are there plans to implement STRICT NCS refinement in Phenix ?? For virus structures I am stuck with using CNS.
Thanks Jon