In article <78e5h5$p20$1 at knot.queensu.ca> you wrote:
> I'm having some strange problems adding hydrogens to a pdb file. Using
> the default tutorial script $XPLOR/tutorial/generate/generate.inp, I find
> that hydrogens are only being added to N and O atoms, not to C. Does
> anyone know what I'm doing wrong?
I should probably provide some clarification as to why I would care about
non-H-bonding hydrogens. I want to take a theoretical pdb file with no
hydrogens and see how well it fits to NMR NOE restraints. Obviously I
need all hydrogens.
Steffen
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*Steffen Graether steffen at crystal.biochem.queensu.ca *
*Dept. of Biochemistry *
*Queen's University, Kingston, Ontario, Canada *
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