Molecular activity prediction by means of supervised subspace projection based ensembles of classifiers
Author:
Affiliation:
1. Department of Computing and Numerical Analysis, University of Córdoba, Campus de Rabanales, Albert Einstein Building, Córdoba, Spain
Funder
Ministerio de Ciencia e Innovación
Publisher
Informa UK Limited
Subject
Drug Discovery,Molecular Medicine,General Medicine,Bioengineering
Link
https://www.tandfonline.com/doi/pdf/10.1080/1062936X.2017.1423376
Reference50 articles.
1. How to improve R&D productivity: the pharmaceutical industry's grand challenge
2. Structure-Based Drug Screening and Ligand-Based Drug Screening with Machine Learning
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4. A Virtual Screening Filter for Identification of Cytochrome P450 2C9 (CYP2C9) Inhibitors
5. Pharmacophoric Fingerprint Method (TOPP) for 3D-QSAR Modeling: Application to CYP2D6 Metabolic Stability
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