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. Author manuscript; available in PMC: 2014 Jul 22.
Published in final edited form as: J Chem Inf Model. 2013 Jul 2;53(7):1563–1575. doi: 10.1021/ci400187y

Table 8.

AAE, average Tanimoto similarity, and standard deviation. Each bin contains 2860 similarity measures.

Bin Number 1 2 3 4
AAE 0.40 0.50 0.51 0.56
similarity (av) 0.95 0.81 0.67 0.52
similarity (st dev) 0.05 0.04 0.04 0.08