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. 2021 Mar 17;27(3):1633–1640. doi: 10.1007/s10989-021-10196-x

Table 2.

Evaluates the intermolecular properties scoring concerning the drug ability between receptor and ligand of the top-5 highest scoring druggable models using Pock Drug

Pockets (receptor) Vol. hull Hydroph Polar Res Aromatic Res Otyr atom Nb Res Drug probability Stand dev
Model 1 554.05 0.83 0.4 0.07 0.03 15.0 0.96 0.02
Model 2 527.35 1.31 0.47 0.33 0.0 12.0 0.99 0.0
Model 3 790.76 − 0.46 0.6 0.4 0.05 15.0 0.87 0.02
Model 4 12,195.9 − 1.26 0.69 0.28 0.02 68.0 0.67 0.08
Model 5 815.8 − 0.91 0.54 0.29 0.02 14.0 0.52 0.05
Pockets
(ligand)
Vol. hull Hydroph Polar Res Aromatic Res Otyr atom Nb Res Drug probability Stand dev
Model 1 948.18 0.48 0.47 0.13 0.02 15.0 0.94 0.01
Model 2 682.88 0.4 0.43 0.07 0.03 14.0 0.89 0.04
Model 3 526.23 0.09 0.64 0.29 0.0 14.0 0.89 0.06