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Table 5 Results of QSAR calculation of 406 flavor chemicals in 2X2 contingency matrix

From: Development of a new quantitative structure–activity relationship model for predicting Ames mutagenicity of food flavor chemicals using StarDrop™ auto-Modeller™

  

StarDrop NIHS 834_67

Derek Nexus 6.1.0

CASE Ultra 1.8.0.2 GT1_BMUT

P

N

P

N

P

N

OOD

Ames test result

P

35

9

31

13

31

12

1

N

13

349

14

348

28

327

7

  1. P positive, N negative, OOD out of domain
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Genes and Environment

ISSN: 1880-7062

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