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These findings can be explained by the fact that, under physiological conditions, water molecules present in the active site are frequently displaced when a ligand binds.32 As a result, including them in docking protocols can be unnecessary—or even misleading—by exaggerating specific interactions and inflating binding scores that do not truly reflect ligand behavior

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Add 1–2mL bacteriostatic water to the lyophilized vial by directing water down the inner wall of the vial