Table 3 Molecular docking and MM-GBSA energy profiles of native ligands and screened top hits during their interaction with LasR, PhzR and RhlR.

From: Exemplifying the next generation of antibiotic susceptibility intensifiers of phytochemicals by LasR-mediated quorum sensing inhibition

  1. ΔGBind = binding energy, ΔGCoulomb = Coulomb energy, ΔGHbond = hudrogen-bonding correction, ΔGLipo = lipophilic energy, ΔGvdW = Van der Waals energy.
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