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. 2022 Jul 2;34(7):102214. doi: 10.1016/j.jksus.2022.102214

Table 2.

A summary of various values obtained after the free binding calculation.

Sr No. Molecule Prime Energy
(ΔG) (kJ/mole)
Prime dG bind
ΔG (kJ/mole)
1. Ebselen −13414.22 −56.45
2. Galangin −13386.98 −49.8
3. Nalsudaldain −13423.68 −69.41
4. Rhamnezine −13406.01 −62.87