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. 2020 Jul 27;88:107348. doi: 10.1016/j.compbiolchem.2020.107348

Table 9.

Molecular docking calculation of 2BT-Rhodanine system with various proteins.

Protein Name Code Interaction energy Etot(kcal/mol) EH-bond EVDW EElect
COX-2 3LN1 −98.37 −91.06 −7.30 0
5-LOX 3V92 −91.07 −72.01 −15.10 −3.95
Human immunodeficiency virus type 1 1DLO −86.23 −74.29 −11.29 0
Bat SARS-like coronavirus 6UL7 −85.09 −74.51 −8.71 −1.86
Feline leukemia virus 1LCS −82.22 −70.03 −10.65 −1.53
Friend murine leukemia virus 1AOL −76.90 −63.29 −10.07 −3.52