QSAR study in the N-aryl-anthranylic acids class

Authors
Citation
T. Laszlo, QSAR study in the N-aryl-anthranylic acids class, REV CHIM, 50(12), 1999, pp. 864-874
Citations number
8
Categorie Soggetti
Chemical Engineering
Journal title
REVISTA DE CHIMIE
ISSN journal
00347752 → ACNP
Volume
50
Issue
12
Year of publication
1999
Pages
864 - 874
Database
ISI
SICI code
0034-7752(199912)50:12<864:QSITNA>2.0.ZU;2-M
Abstract
The article is presenting a new calculation programme for me QSPR/QSAR equa tions. The essential characteristics of this programme are: It calculates global, local and area characteristics for each molecule; It selects the variables, considering the molecules characteristics having an unknown value for the property studied; It calculates multilinear equations by regression; It calculates equations coefficients by the Lineary Correlation Maximum Met hod (MMCL). A comparison done, between the results got with the new PRECLAV programme a nd those obtained with CODESSA, in a QSAR study employing on 112 N-arylanth ranylic acids.