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Chapter 9 Molecular Similarity: Advances in Methods, Applications and Validations in Virtual Screening and QSAR

This chapter discusses recent developments in some of the areas that exploit the molecular similarity principle, novel approaches to capture molecular properties by the use of novel descriptors, focuses on a crucial aspect of computational models—their validity, and discusses additional ways to exam...

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Detalles Bibliográficos
Autores principales: Bender, Andreas, Jenkins, Jeremy L., Li, Qingliang, Adams, Sam E., Cannon, Edward O., Glen, Robert C.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier B.V. 2006
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7185533/
https://www.ncbi.nlm.nih.gov/pubmed/32362803
http://dx.doi.org/10.1016/S1574-1400(06)02009-3