TABLE 2.

Result of virtual screen using Glide, showing the docking score and ranked MM/GBSA binding free energy of docked poses^a

Drug name	Docking score	MM/GBSA ΔGbind (kcal/mol)
Anidulafungin	−8.774	−88.602
Bleomycin	−9.153	−88.376
Micafungin	−7.743	−67.817
Plicamycin	−6.771	−62.403
Nafarelin	−7.063	−57.569
Edoxaban	−6.834	−57.338
Cefiderocol	−6.936	−56.279
Imidurea	−7.492	−52.435
Chloramphenicol succinate	−6.381	−51.324
FAD	−6.764	−50.823
Imipenem	−5.22	−49.288
Cangrelor	−6.688	−48.58
Arbutin	−6.537	−47.345
Cefonicid	−5.834	−45.845
Fondaparinux	−6.573	−42.516

^aScreen result with an energy lower than −42.266 kcal/mol.