JOURNAL ARTICLE
ADME properties evaluation in drug discovery: in silico prediction of blood–brain partitioning
Lu ZhuJunnan ZhaoYanmin ZhangWeineng ZhouLinfeng YinYuchen WangYuanrong FanYadong ChenHaichun Liu
Year: 2018 Journal: Molecular Diversity Vol: 22 (4)Pages: 979-990 Publisher: Springer Science+Business Media
Keywords:
Polar surface area ADME Multivariate statistics Linear regression Partition coefficient Quantitative structure–activity relationship Drug discovery In silico Random forest Multivariate adaptive regression splines Computer science Biological system Bayesian multivariate linear regression Artificial intelligence Chemistry Drug Machine learning Pharmacology Medicine Biology Chromatography
Metrics
43
Cited By
3.47
FWCI (Field Weighted Citation Impact)
48
Refs
0.92
Citation Normalized Percentile
Is in top 1%
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Citation History
Topics
Computational Drug Discovery Methods
Physical Sciences → Computer Science → Computational Theory and Mathematics
Analytical Chemistry and Chromatography
Physical Sciences → Chemistry → Spectroscopy
Spectroscopy and Chemometric Analyses
Physical Sciences → Chemistry → Analytical Chemistry
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