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Table 1 Counts of 3430 total RMSD calculations whose error relative to the deterministic DockRMSD calculation is zero, small (nonzero but smaller than 2.0 Å), or large (greater than 2.0 Å)

From: DockRMSD: an open-source tool for atom mapping and RMSD calculation of symmetric molecules through graph isomorphism

 

N (Error = 0)

N (0 < Error ≤ 2.0 Å)

N (Error > 2.0 Å)

Naïve

2109 (61.5%)

1267 (36.9%)

54 (1.6%)

Hungarian

161 (4.7%)

2548 (74.3%)

721 (21.0%)