Table 1.

Free energy (kcal/mol) decomposition of the system.

System	VDWAALS	EEL	EPB	GGAS	GSOLV	TOTAL
Sorafenib-HMGR	−33.36	−9.08	24.18	−42.43	20.66	−21.77
Sulfaphenazole-HTR2C	−40.46	−25.19	47.61	−65.65	43.85	−21.8
Prasterone-RXRA	−40.58	−4.79	28.13	−45.37	24.46	−20.91
Promega-MTP	−54.42	−12.94	29.03	−67.37	23.75	−43.61
Argatroban-FX	−43.33	−104.81	126.13	−148.14	121.22	−26.92