[sharp-discuss] SHARP with multiple SAD datasets and ignore isomorphous differences?
Francis E Reyes
Francis.Reyes at Colorado.EDU
Thu Jun 2 00:44:45 CEST 2011
Hi all
I'm curious about using multiple SAD datasets with poor isomorphism
among them. I imagine I can specify multiple C-sites and multiple G-
sites for each respective compound.
However, how do I tell sharp to ignore the isomorphous differences?
Also, should scaling parameters be estimated/refined at all? I imagine
that each compound will have its own Multiplier and isotropic scale
factor.
Also, I imagine NANO_BGLO and NANO_CLOC should be refined as well?
Thanks!
F
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Francis E. Reyes M.Sc.
215 UCB
University of Colorado at Boulder
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