Selected 430 top-children targeting the A3A dimer-interface (Figure , red arrow) were ADV docked to similar sites at the A3 models (A3A, A3B,A3C,A3D, A3F,A3G,A3H and AID, different colours). Each A3A-3D aligned A3 model was ADV docked using the same centerofmass and 20x20x20 Å gridboxes surrounding the dimerinterfaces (Figure , grey cube) (Supplementary Materials / A3Dimers-3DAligned.sdf). Both top-children targeting ssDNA-docking and dimer-interface predicted star-shaped molecular structures. Most probably due to their derivation from starshaped parents (star8 and star36, respectively). The pdbqt docked conformers targeted similar sites either on the monomer B chain (Figure , red spheres) or on the BA dimer chains (Figure , green spheres). These top-children are only one of the many other possible solutions for best docking. Given the existence of a vast chemical space, other star-or no-star-shaped possibilities should exist.