TABLE 1.
Compounds | Structure | Grid score (kcal/mol) | Amber score (kcal/mol) |
---|---|---|---|
C791-0064 | −41.37 | −38.36 | |
E859-1790 | −45.35 | −35.58 | |
G889-2311 | −38.49 | −35.86 | |
F345-0611 | −41.92 | −39.91 | |
G672-0331 | −38.36 | −35.13 |
Compounds | Structure | Grid score (kcal/mol) | Amber score (kcal/mol) |
---|---|---|---|
C791-0064 | −41.37 | −38.36 | |
E859-1790 | −45.35 | −35.58 | |
G889-2311 | −38.49 | −35.86 | |
F345-0611 | −41.92 | −39.91 | |
G672-0331 | −38.36 | −35.13 |