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. Author manuscript; available in PMC: 2010 May 13.
Published in final edited form as: J Comput Chem. 2007 Jan 30;28(2):495–507. doi: 10.1002/jcc.20474

Figure 2.

Figure 2

a) CHARMM27 standard and modified nucleotide residues: b) A standard CHARMM27 ribonucleotide analog (no base) with the 2′ position protonated; c) 2′ deprotonated ribose phosphate (i.e., activated at the 2′ position); d) ribose phosphorane (i.e., intermediate/transition state model); 2′,3′-cyclic ribose phosphate (i.e., transesterification product). Color coding of atoms is as follows: carbon=turquoise, oxygen=red, phosphorous=brown, hydrogen=white.