> http://www.bmrb.wisc.edu/referenc/aa_chem.html
Second reference on this page: http://www.bmrb.wisc.edu/ref_info/atom_nom.tbl
It seems to me that this is the sort of thing you are looking for? Holy cow! That's quite a list. Would you like, basically, to add a CIF or mmCIF column? Or isn't this the right list? (From which perhaps you could design an algorithm?)
see the files in the pdb ftp area under directory data/monomers/ components.cif (PDB names) components_iupac.cif (mmcif iupac names)
The above two look like a good bet. What exactly are you after, Miguel? What are the desired inputs and outputs?
Bob
Robert M. Hanson, [EMAIL PROTECTED], 507-646-3107 Professor of Chemistry, St. Olaf College 1520 St. Olaf Ave., Northfield, MN 55057 mailto:[EMAIL PROTECTED] http://www.stolaf.edu/people/hansonr
"Imagination is more important than knowledge." - Albert Einstein
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