Table 2

Results for the selective test cases

Ligand

Number of Atoms

Average FEB (kcal/mol)

Total Results FEB (-)

Total Results FEB (+)

Total Results Not Docked

Average RMSD (Å)

Computer Architecture

CPU Time (hs)


PIF

28

-9.9 ± 0.5

1,000

0

0

4.8 ± 1.4

-

-

TCL

24

-8.8 ± 0.3

1,000

0

0

6.7 ± 1.7

-

-

ETH

21

-6.7 ± 0.3

984

0

16

5.2 ± 2.4

PC2

80


See Table 1 for details about the table contents.

Machado et al. BMC Genomics 2011 12(Suppl 4):S6   doi:10.1186/1471-2164-12-S4-S6

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