Solubility Challenge: Can You Predict Solubilities of 32 Molecules Using a Database of 100 Reliable Measurements?
Author:
Affiliation:
1. Pfizer Institute for Pharmaceutical Materials Science & Unilever Centre for Molecular Informatics, Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, United Kingdom
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/ci800058v
Reference30 articles.
1. INVESTIGATIONS OF SOME PHYSICOCHEMICAL PROPERTIES OF HALOPERIDOL WHICH MAY AFFECT ITS ACTIVITY
2. Oral versus intravenous vinorelbine: clinical safety profile
3. Severe renal toxicity due to intermediate-dose methotrexate
4. Managing the drug discovery/development interface
Cited by 174 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. Effect of Data Quality and Data Quantity on the Estimation of Intrinsic Solubility: Analysis Based on a Single-Source Data Set;Molecular Pharmaceutics;2024-09-13
2. Revisiting the Application of Machine Learning Approaches in Predicting Aqueous Solubility;ACS Omega;2024-07-31
3. Graph Neural Networks for Predicting Solubility in Diverse Solvents Using MolMerger Incorporating Solute–Solvent Interactions;Journal of Chemical Theory and Computation;2024-07-23
4. Direct radiolabeling of methotrexate and methotrexate micelles with Tc-99m using QbD approach;Applied Radiation and Isotopes;2024-07
5. Unsupervised manifold embedding to encode molecular quantum information for supervised learning of chemical data;Communications Chemistry;2024-06-11
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