Comparison of Two Methods for Predicting Aqueous Solubility
Author:
Affiliation:
1. Department of Pharmaceutical Sciences, College of Pharmacy, The University of Arizona, 1703 E. Mabel Street, Tucson, Arizona 85721
Publisher
American Chemical Society (ACS)
Subject
Computational Theory and Mathematics,Computer Science Applications,Information Systems,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/ci010298s
Reference12 articles.
1. Estimation of the Aqueous Solubility of Organic Molecules by the Group Contribution Approach
2. Yalkowsky, S. H.Solubility and solubilization in aqueous media; Oxford University Press: New York, 1999.
3. Estimation of aqueous solubility of organic molecules by the group contribution approach. Application to the study of biodegradation
Cited by 37 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. Novel Solubility Prediction Models: Molecular Fingerprints and Physicochemical Features vs Graph Convolutional Neural Networks;ACS Omega;2022-04-04
2. Prediction of aqueous solubility by treatment of COSMO-RS data with empirical solubility equations: the roles of global orbital cut-off and COSMO solvent radius;Theoretical Chemistry Accounts;2019-05-28
3. DMol 3 /COSMO-RS prediction of aqueous solubility and reactivity of selected Azo dyes: Effect of global orbital cut-off and COSMO segment variation;Journal of Molecular Liquids;2018-01
4. Estimation of water-hydrocarbon mutual solubility in gas processing operations using an intelligent model;Petroleum Science and Technology;2016-02-16
5. Validation of quantitative structure–activity relationship models to predict water-solubility of organic compounds;Science of The Total Environment;2013-10
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3