Proposicao, validacao e analise dos modelos que correlacionam estrutura quimica e atividade biologica



Document title: Proposicao, validacao e analise dos modelos que correlacionam estrutura quimica e atividade biologica
Journal: Quimica nova
Database: PERIÓDICA
System number: 000198653
ISSN: 0100-4042
Authors: 1
Institutions: 1Universidade Federal do Espirito Santo, Centro de Ciencias Exatas, Vitoria, Espirito Santo. Brasil
Year:
Season: Sep-Oct
Volumen: 24
Number: 5
Pages: 658-671
Country: Brasil
Language: Portugués
Document type: Artículo
Approach: Teórico, divulgación
English abstract The present paper aims to bring under discussion some theoretical and practical aspects about the proposition, validation and analysis of QSAR models based on multiple linear regression. A comprehensive approach for the derivation of extrathermodynamic equations is reviewed. Some examples of QSAR models published in the literature are analyzed and criticized
Disciplines: Química
Keyword: Fisicoquímica y química teórica,
Química farmacéutica,
Química orgánica,
Validación,
Relación estructura-actividad,
Modelos QSAR,
Actividad biológica,
Estructura química
Keyword: Chemistry,
Medicinal chemistry,
Organic chemistry,
Physical and theoretical chemistry,
Validation,
Structure-activity relationship,
QSAR models,
Biological activity,
Chemical structure
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