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QSAR and 3D-QSAR studies applied to compounds with anticonvulsant activity
(Informa Healthcare, 2014-10-09)
Quantitative structure--activity relationships (QSAR and 3D-QSAR) have been applied in the last decade to obtain a reliable statistical model for the prediction of the anticonvulsant activities of new chemical entities. ...
Influence of spatial information coding into 2D and 3D descriptors for QSAR modelling purposesInfluência da codificação de informações espaciais em descritores 2D e 3D para fins de modelagem QSAR
(Universidade Federal de LavrasPrograma de Pós-graduação em AgroquímicaUFLAbrasilDepartamento de Química, 2023)
MIA-QSAR modeling of activities of a series of AZT analogues: bi- and multilinear PLS regression
(Taylor & Francis, 2020)
Fragment-based QSAR strategies in drug design
(Informa HealthcareLondon, 2010-05)
Recently, fragment-based drug design has been established as a crucial strategy for hit identification and lead generation, which has strongly encouraged the development of approaches to specifically recognize and evaluate ...