Solubility Prediction Using Neural Network and Chemical Explanation of Deep Learning Model

Amane Suzuki, Yuichiro Kikura, Kenichi Tanaka, K. Funatsu
{"title":"Solubility Prediction Using Neural Network and Chemical Explanation of Deep Learning Model","authors":"Amane Suzuki, Yuichiro Kikura, Kenichi Tanaka, K. Funatsu","doi":"10.2751/JCAC.19.1","DOIUrl":null,"url":null,"abstract":"","PeriodicalId":41457,"journal":{"name":"Journal of Computer Aided Chemistry","volume":"3 1","pages":"1-6"},"PeriodicalIF":0.0000,"publicationDate":"2018-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.2751/JCAC.19.1","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Computer Aided Chemistry","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.2751/JCAC.19.1","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
查看原文
分享 分享
微信好友 朋友圈 QQ好友 复制链接
本刊更多论文
基于神经网络的溶解度预测和深度学习模型的化学解释
本文章由计算机程序翻译,如有差异,请以英文原文为准。
求助全文
约1分钟内获得全文 去求助
相关文献
Predicting inadequate bowel preparation for colonoscopy in participants receiving split-dose bowel preparation: development and validation of a prediction score
IF 7.7 1区 医学Gastrointestinal endoscopyPub Date : 2015-03-01 DOI: 10.1016/j.gie.2014.09.066
Vincent K. Dik MD , Leon M.G. Moons MD, PhD , Melek Hüyük BSc , Peter van der Schaar MD, PhD , Wouter H. de Vos tot Nederveen Cappel MD, PhD , Pieter C.J. ter Borg MD, PhD , Maarten A.C. Meijssen MD, PhD , Rob J.T.H. Ouwendijk MD, PhD , Doris M. Le Fèvre , Merijn Stouten , Onno van der Galiën , Theo J. Hiemstra , Jan F. Monkelbaan MD , Martijn G.H. van Oijen PhD , Peter D. Siersema MD, PhD
Development and Validation of a Scoring System for Early Diagnosis of Malignant Pleural Effusion Based on a Nomogram.
IF 4.7 3区 材料科学ACS Applied Electronic MaterialsPub Date : 2021-12-07 DOI: 10.3389/fonc.2021.775079
Aihua Wu, Zhigang Liang, Songbo Yuan, Shanshan Wang, Weidong Peng, Yijun Mo, Jing Yang, Yanqing Liu
来源期刊
Journal of Computer Aided Chemistry
Journal of Computer Aided Chemistry CHEMISTRY, MULTIDISCIPLINARY-
自引率
0.00%
发文量
0
期刊最新文献
A method to search the most stable reaction pathway and its application to the Pinner Pyrimidine Synthesis reaction Extended Regression Modeling of the Toxicity of Phenol Derivatives to Tetrahymena pyriformis Using the Electronic-Structure Informatics Descriptor Solvatochromism of 4-(diethylamino)-4’-nitroazobenzene: explanation based on CNDO/S calculation results Prediction of Compound Cytotoxicity Based on Compound Structures and Cell Line Molecular Characteristics [Special Issue for Honor Award dedicating to Prof Kimito Funatsu]Kimito Funatsu – Driving Force of Japanese-French Collaboration in Chemoinformatics
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
已复制链接
已复制链接
快去分享给好友吧!
我知道了
×
扫码分享
扫码分享
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1