Internal Test Sets Studies in a Group of Antimalarials

Internal Test Sets Studies in a Group of Antimalarials

Topological indices have been applied to build QSAR models for a set of 20 an-timalarial cyclic peroxy cetals. In order to evaluate the reliability of the proposed linearmodels leave-n-out and Internal Test Sets (ITS) approaches have been considered. The pro-posed procedure resulted in a robust and...

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Bibliographic Details
Main Authors: E. Besalú, J. V. de Julián-Ortiz
Format: Article
Language:English
Published: MDPI AG 2006-10-01
Series:International Journal of Molecular Sciences
Subjects:
Internal test sets method
topological indices
linear models
QSAR
statistical validation.
Online Access:http://www.mdpi.com/1422-0067/7/10/456/

Internet

http://www.mdpi.com/1422-0067/7/10/456/

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