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. Author manuscript; available in PMC: 2010 May 17.
Published in final edited form as: J Med Chem. 2006 Jul 13;49(14):4367–4373. doi: 10.1021/jm0601553

Table 3.

Prediction of inhibitors and noninhibitors with LWRP method and 9 Descriptors.

2C9 2D6 3A4
Scheme Normed Ranked Normed Ranked Normed Ranked
Concordance 90.60 90.10 89.20 89.60 85.00 84.80
Specificity 96.95 97.32 96.00 97.00 94.93 95.47
Sensitivity 61.67 57.22 62.00 60.00 55.20 52.80
λ 0.658526 0.633335 0.662455 0.660285 0.570278 0.561880