Studies of 3D-quantitative structure-activity relationships on a set of nitroaromatic compounds: CoMFA, advanced CoMFA and CoMSIA

Chemosphere

Volumn 48, Issue 7, 2002, Pages 707-715

  Xu, Man ^a   Zhang, Aiqian ^a   Han, Shuokui ^a   Wang, Liansheng ^a  

^a NANJING UNIVERSITY   (China)

Author keywords

3D QSAR; Advanced CoMFA; CoMFA; CoMSIA; Nitroaromatic compound

Indexed keywords

AROMATIC COMPOUNDS; CONTOUR MEASUREMENT; MOLECULAR STRUCTURE; STATISTICAL METHODS; TOXICITY;

CONTOUR MAPS;

NITROGEN COMPOUNDS;

AROMATIC NITRO COMPOUND; ENVIRONMENTAL CHEMICAL; NITROGEN DERIVATIVE;

PHYSICOCHEMICAL PROPERTY;

ANIMAL MODEL; ARTICLE; CHEMICAL ANALYSIS; CHEMICAL STRUCTURE; COMPARATIVE STUDY; CORRELATION ANALYSIS; NONHUMAN; PHYSICAL CHEMISTRY; RELIABILITY; STATISTICAL MODEL; STRUCTURE ACTIVITY RELATION; TOXICITY TESTING; CHEMISTRY; CONFORMATION; QUANTITATIVE STRUCTURE ACTIVITY RELATION;

MODELS, MOLECULAR; MOLECULAR CONFORMATION; NITROGEN COMPOUNDS; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 0035993523     PISSN: 00456535     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0045-6535(02)00165-0     Document Type: Article

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