chemical shift constraints
johnk at spork.niddk.nih.gov
Mon Sep 30 14:41:27 EST 1996
Elias Br|ms wrote:
> Professor Sybren Wijmenga at the Department of Medical Biochemistry
> and Biophysics at Umea University, Sweden, needs in X-PLOR "the
> possibility for chemical shift constraints in NMR structure
> refinement of nucleic acids".
> Is this something the latest version of X-PLOR can do?
> If not, has it been implemented by someone else?
No, the chemical shift code I contributed to the new xplor doesn't
know how to take nucleic acid effects into account. As far as I know,
no one else has a nucleic acid chemical shift refinement package, but
David Case is working on a set of chemical shift parameters for nucleic
acids. When his method becomes available, then I should be able to get
it implemented in xplor relatively quickly.
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John Kuszewski || |/ /| ||
johnk at spasm.niddk.nih.gov || / /|| ||
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that's MISTER protein G to you! |/__/| |
My parents went to Zaire and all I got
was this lousy retrovirus.
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