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Characterization of Promiscuous Binding of Phosphor Ligands to Breast-Cancer-Gene 1 (BRCA1) C-Terminal (BRCT): Molecular Dynamics, Free Energy, Entropy and Inhibitor Design

Fig 8

Calculated versus experimental relative binding free energies ΔΔG (kcal/mol) for P1–P14 and C1.

doi: https://doi.org/10.1371/journal.pcbi.1005057.g008