Estimation of the toxicity of organic compounds to Tetrahymena pyriformis by QSAR method

被引：0

作者：

Vazhev, V. V. ^{[1
]}

Gubenko, M. A. ^{[2
]}

Vazheva, N. V. ^{[2
]}

Ergalieva, E. M. ^{[2
]}

Samsonyuk, E. A. ^{[3
]}

机构：

[1] Kostanay Social & Tech Univ, Kostanay, Kazakhstan

[2] Kostanay State Pedag Inst, Kostanay, Kazakhstan

[3] Kostanay State Univ, Kostanay, Kazakhstan

来源：

BULLETIN OF THE UNIVERSITY OF KARAGANDA-CHEMISTRY | 2016年 / 83期

关键词：

D O I：

暂无

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

The possibility of the use of QSAR / QSPR method is investigated for estimating the toxicity of organic compounds -lg (IGC(50)) to Tetrahymena pyriformis using a large set of descriptors. The set of substances from 1093 compounds is investigated. For all set correlation indicators are received R = 0,968, s = 0,26. For training set there are R = 0,980, s = 0,21, for test -R = 0,943, s = 0,32.

引用

页码：39 / 44

页数：6

共 9 条

[1]

Bellifa K., 2012, ARABIAN J CHEM

[2]

Bouaoune A., 2012, J ENV SCI ENG A, V1, P663

[3] An evaluation of global QSAR models for the prediction of the toxicity of phenols to Tetrahymena pyriformis [J].