An integrated quantitative structure and mechanism of action-activity relationship model of human serum albumin binding

An integrated quantitative structure and mechanism of action-activity relationship model of human serum albumin binding

Abstract Background Traditional quantitative structure-activity relationship models usually neglect the molecular alterations happening in the exposed systems (the mechanism of action, MOA), that mediate between structural properties of compounds and phenotypic effects of an exposure. Results Here,...

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Bibliographic Details
Main Authors: Angela Serra, Serli Önlü, Pietro Coretto, Dario Greco
Format: Article
Language:English
Published: BMC 2019-06-01
Series:Journal of Cheminformatics
Subjects:
QSAR
MOA
QSMARt
Molecular descriptors
Human serum albumin binding
Integrative analysis
Online Access:http://link.springer.com/article/10.1186/s13321-019-0359-2

Internet

http://link.springer.com/article/10.1186/s13321-019-0359-2

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