Binary Classification of Aqueous Solubility Using Support Vector Machines with Reduction and Recombination Feature Selection
Author:
Affiliation:
1. National Center for Biotechnology Information, National Library of Medicine, National Institutes of Health, 8600 Rockville Pike, Bethesda, Maryland 20894, United States
Funder
National Institutes of Health
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/ci100364a
Reference59 articles.
1. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings 1PII of original article: S0169-409X(96)00423-1. The article was originally published in Advanced Drug Delivery Reviews 23 (1997) 3–25. 1
2. ADMET in silico modelling: towards prediction paradise?
3. In silicoprediction of aqueous solubility
4. Recent progress in the computational prediction of aqueous solubility and absorption
5. Estimation of Aqueous Solubility for a Diverse Set of Organic Compounds Based on Molecular Topology
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