Hi,
I am refining my first structure (Cd-SAD) with the Phenix (GUI) and would like to refine anomalous f' and f". When i check the box, a menu appears and I have no idea of how to define the Cd atoms.
I looked at the help and FAQ and found this:
refinement.refine.anomalous_scatterers {
group {
selection = name BR
f_prime = 0
f_double_prime = 0
refine = *f_prime *f_double_prime
So I thought the name should be input as CD in the gui but when I submitted the refinement I got an error.
Any help here would be appreciated?
Thanks,
John Rose