Application of Multivariate Adaptive Regression Splines (MARSplines) for Predicting Antitumor Activity of Anthrapyrazole Derivatives

An approach using multivariate adaptive regression splines (MARSplines) was applied for quantitative structure–activity relationship studies of the antitumor activity of anthrapyrazoles. At the first stage, the structures of anthrapyrazole derivatives were subjected to geometrical optimization by th...

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Detalhes bibliográficos
Main Authors: Marcin Gackowski, Karolina Szewczyk-Golec, Robert Pluskota, Marcin Koba, Katarzyna Mądra-Gackowska, Alina Woźniak
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI AG 2022-05-01
Colecção:International Journal of Molecular Sciences
Assuntos:
anthrapyrazoles
antitumor activity
multivariate adaptive regressions splines
quantitative structure-activity relationships (QSAR)
Acesso em linha:https://www.mdpi.com/1422-0067/23/9/5132
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