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. 2025 Sep 30;15:33964. doi: 10.1038/s41598-025-11516-7

Table 5.

Molecular Docking energies (k.cal/mol) of the tested (6a-g) ligands.

Compound rsmd_refine E_conf E_refine
6a 2.3645 −32.7606 −44.0843
6b 1.4026 −67.3454 −31.7621
6c 3.4816 −119.5328 −37.8596
6d 1.8745 −131.3019 −39.2624
6e 1.6810 −185.3885 −32.8882
6f 2.1297 −132.1769 −36.6606
6 g 1.7305 −45.1289 −29.9268
Streptomycin 1.3066 −105.2598 −38.8258
Ciprofloxacin 1.1013 128.4994 −16.8805
Tetracycline 1.3439 −17.5973 −29.8420
Chloramphenicol 1.1725 100.3267 −27.6884