发布求助
文献互助 智能选刊 最新文献

Journal of Computer Chemistry-Japan最新文献

筛选
英文 中文
Molecular Orbital Analysis of Adhesive Molecules UsingMolecular Simulation 基于分子模拟的黏附分子分子轨道分析
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2022-0010
Misaki Mizushima, Kazuhiro Sasa, M. Furutani
{"title":"Molecular Orbital Analysis of Adhesive Molecules UsingMolecular Simulation","authors":"Misaki Mizushima, Kazuhiro Sasa, M. Furutani","doi":"10.2477/jccj.2022-0010","DOIUrl":"https://doi.org/10.2477/jccj.2022-0010","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"1 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69048612","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The tremendous contribution of Winmostar developerNorio Senda Winmostar开发者norio Senda的巨大贡献
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2022-0016
Y. Honma
{"title":"The tremendous contribution of Winmostar developerNorio Senda","authors":"Y. Honma","doi":"10.2477/jccj.2022-0016","DOIUrl":"https://doi.org/10.2477/jccj.2022-0016","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"1 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69049242","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The Past and Future of the Journal of Computer Chemistry, Japan 《计算机化学杂志的过去与未来》，日本
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2022-0014
Keiko Nakamura
{"title":"The Past and Future of the Journal of Computer Chemistry, Japan","authors":"Keiko Nakamura","doi":"10.2477/jccj.2022-0014","DOIUrl":"https://doi.org/10.2477/jccj.2022-0014","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"1 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69049514","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Theoretical Study on the Conduction Properties of π-Stacked Single-Molecule Junctions with Stacked Aromaticity 具有堆叠芳香性的π-堆叠单分子结传导特性的理论研究
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2023-0002
{"title":"Theoretical Study on the Conduction Properties of π-Stacked Single-Molecule Junctions with Stacked Aromaticity","authors":"","doi":"10.2477/jccj.2023-0002","DOIUrl":"https://doi.org/10.2477/jccj.2023-0002","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"1 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69051241","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
シトクロムcの複合体形成過程の再現シミュレーション 细胞色素c复合体形成过程的再现模拟
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2023-0014
H. Shimoyama, Y. Shigeta
{"title":"シトクロムcの複合体形成過程の再現シミュレーション","authors":"H. Shimoyama, Y. Shigeta","doi":"10.2477/jccj.2023-0014","DOIUrl":"https://doi.org/10.2477/jccj.2023-0014","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"1 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69052490","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Data-driven Reaction Pathway Estimation with Efficient Use of Small Number of Data 有效利用少量数据的数据驱动反应路径估计
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2022-0024
Tomoki Shionoya, Iori Shimada
{"title":"Data-driven Reaction Pathway Estimation with Efficient Use of Small Number of Data","authors":"Tomoki Shionoya, Iori Shimada","doi":"10.2477/jccj.2022-0024","DOIUrl":"https://doi.org/10.2477/jccj.2022-0024","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"1 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69049933","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Peripheral Modification and Central Localizationin quasi-crystalline Penrose Tile Clusters 准晶体Penrose瓷砖簇的外围修饰和中心定位
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2022-0006
Tsubasa Kanezaki, Gakushi Ishii, K. Takeda
{"title":"Peripheral Modification and Central Localizationin quasi-crystalline Penrose Tile Clusters","authors":"Tsubasa Kanezaki, Gakushi Ishii, K. Takeda","doi":"10.2477/jccj.2022-0006","DOIUrl":"https://doi.org/10.2477/jccj.2022-0006","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"1 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69048480","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
On Molecular Dynamics Simulations of Silicate Melt/Glass−Molecular Simulations of Inorganic Compounds− 硅酸盐熔体/玻璃的分子动力学模拟−无机化合物的分子模拟−
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2022-0012
K. Kawamura
{"title":"On Molecular Dynamics Simulations of Silicate Melt/Glass−Molecular Simulations of Inorganic Compounds−","authors":"K. Kawamura","doi":"10.2477/jccj.2022-0012","DOIUrl":"https://doi.org/10.2477/jccj.2022-0012","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"1 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69049064","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Electronic State of Hydroxyl-terminated Dimeric Titanium Structure 端羟基二聚体钛结构的电子态
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2022-0032
Y. Ohko, U. Nagashima
{"title":"Electronic State of Hydroxyl-terminated Dimeric Titanium Structure","authors":"Y. Ohko, U. Nagashima","doi":"10.2477/jccj.2022-0032","DOIUrl":"https://doi.org/10.2477/jccj.2022-0032","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"3 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69050477","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Investigation of Computational Methods for Membrane Permeability of Middle-Sized Molecules 中等分子膜透性计算方法的研究
IF 0.1
Journal of Computer Chemistry-Japan Pub Date : 2022-01-01 DOI: 10.2477/jccj.2023-0007
T. Takahashi, K. Hengphasatporn, R. Harada, Y. Shigeta
{"title":"Investigation of Computational Methods for Membrane Permeability of Middle-Sized Molecules","authors":"T. Takahashi, K. Hengphasatporn, R. Harada, Y. Shigeta","doi":"10.2477/jccj.2023-0007","DOIUrl":"https://doi.org/10.2477/jccj.2023-0007","url":null,"abstract":"","PeriodicalId":41909,"journal":{"name":"Journal of Computer Chemistry-Japan","volume":"112 1","pages":""},"PeriodicalIF":0.1,"publicationDate":"2022-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"69051126","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
首页 上一页 下一页 尾页
0
×
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
请完成安全验证×
相关产品
×
本文献相关产品
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 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号：481959085
Book学术官方微信