Hi all,
I am using a script modified from ../eninput/gb1_rdc/refine.py to
refine a structure with distance restraints and RDCs. Now I want to add the
Ca and Cb chemical shift restraints. I find an example about Carbon chemical
shift potential in ../eninput/mef_dna. But the refine script in this
directory is much different to that I used currently.
Does anyone have an idea how to add the Carbon chemical shift
potential to the ../eninput/gb1_rdc/refine.py to refine a protein structure?
Thanks,
Xiaogang
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