“One Ring to Bind Them All”—Part II: Identification of Promising G-Quadruplex Ligands by Screening of Cyclophane-Type Macrocycles

Figure 5

Lowest energy conformations of (a) 3,3^-BisBP and (b) 3,3^-TrisBP (front and side-view) during a molecular dynamic simulation in a water box [29].

(a)

(b)