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. 2023 Jul 12;88(14):10111–10121. doi: 10.1021/acs.joc.3c00930

Figure 5.

Figure 5

Stable conformations of G-CPD during the MD simulation. G–G π-stacking (A), G-T π-stacking (B), and G–G hydrogen bonding (C). Relevant atom distances (in Å) are highlighted (see numbering in Figure S3).