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. Author manuscript; available in PMC: 2014 Dec 23.
Published in final edited form as: J Chem Inf Model. 2013 Dec 10;53(12):3127–3130. doi: 10.1021/ci4005282

Table 5.

Mean prediction time per molecule in seconds (with standard deviation).

COSMOS with free library Open Babel with OB library RDKIT Balloon
0.06 (0.16) 0.77 (0.74) 0.19 (0.28) 1.71 (3.85)