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. 2015 Oct 22;24(6):1229–1242. doi: 10.1016/j.sjbs.2015.10.003

Table 4.

Orbital energy of the selected inhibitors of the MDPI database

S. No. Compound name HOMO energy LUMO energy HLG (eV)
1 MDPI14871 −0.19363 −0.05277 0.14086
2 MDPI20746 −0.20836 −0.06113 0.14723
3 MDPI14352 −0.21861 −0.10158 0.11703