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. Author manuscript; available in PMC: 2014 Dec 10.
Published in final edited form as: J Chem Theory Comput. 2013 Oct 28;9(12):5526–5538. doi: 10.1021/ct4005992

Table 3.

RMSD values (Å) and standard deviations of RMSD (Å) from the MT heatmap docking results, compared with Glide SP and Glide XP results.

RMSD (Å) RMSD standard deviation (Å)
MT KECSA 1.97 1.27
Glide SP 2.07 2.72
Glide XP 1.87 2.01