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. Author manuscript; available in PMC: 2016 Apr 19.
Published in final edited form as: Phys Chem Chem Phys. 2014 Jul 28;16(28):14368–14377. doi: 10.1039/c4cp00908h

Figure 3.

Figure 3

The HOMO orbitals on the guanine bases are shown in green. For an ideal structure (poly-GT), the HOMO on the DNA strand is delocalized over several guanines, i.e. this HOMO can be modeled as a superposition of HOMO’s of the individual bases.