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. 2018 Aug 14;8(50):28775–28786. doi: 10.1039/c8ra04261f

Relative Gibbs free energies (kJ mol−1) of the interaction between the target/analogous molecules and MAA, and the molar volumes of the target and analogous molecules (bohr3 mol−1). Clo = chloroform and Tol = toluene.

ΔΔG Volume
Clo Tol Clo Tol
Quinoline 0.00 0.00 1335.92 1320.61
DBT 68.07 66.61 1609.87 1586.63
Carbazole 36.72 46.32 1442.77 1325.16