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. 2023 Aug 1;30(9):103753. doi: 10.1016/j.sjbs.2023.103753

Table 3.

Energy values of different Complexes obtained during MD simulations.

Sl. No. Complex Binding free energy (Kcal/mol)
1 SOD_BACILLIBACTIN −30.522+/-28.764 kJ/mol
2 SOD_PAENIBACTIN −53.739+/-39.348 kJ/mol
3 SOD_LICHENYSIN −128.070+/-13.610 kJ/mol