AMBER Archive (2005)

Subject: AMBER: 6-thioguanine

From: E.A.Moore (E.A.Moore_at_open.ac.uk)
Date: Tue Dec 06 2005 - 08:31:59 CST


No-one on this list has claimed to have developed parameters for this
but I have found a paper that does so. In case anyone else is
interested, the reference is N. Spackova, E. Cubero, J.Sponer and M.
Orozco, JACS, vol. 126, pp. 14642-14650, 2004.
Enclosed is a file I made from this data to enable insertion of a
thioguanine residue.
 <<TG.doc>>
Elaine A. Moore,
Chemistry Department,
The Open University,
UK



  • application/msword attachment: TG.doc
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