Pub Date : 2019-05-07DOI: 10.1201/9780429070655-177
H. Dodziuk
{"title":"Modeling of Molecular and Chiral Recognition by Cyclodextrins","authors":"H. Dodziuk","doi":"10.1201/9780429070655-177","DOIUrl":"https://doi.org/10.1201/9780429070655-177","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"5 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"130943110","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}
Pub Date : 2019-05-07DOI: 10.1201/9780429070655-86
J. Makowska, M. Makowski, L. Chmurzyński
{"title":"Theoretical Studies on the Alanine-rich Peptide","authors":"J. Makowska, M. Makowski, L. Chmurzyński","doi":"10.1201/9780429070655-86","DOIUrl":"https://doi.org/10.1201/9780429070655-86","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"209 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"132783485","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}
Pub Date : 2019-05-07DOI: 10.1201/9780429070655-60
Josef Kapitán, J. Sebek, P. Bouř
{"title":"Different Effect of Solvent on Electronic and Vibrational Spectra","authors":"Josef Kapitán, J. Sebek, P. Bouř","doi":"10.1201/9780429070655-60","DOIUrl":"https://doi.org/10.1201/9780429070655-60","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"155 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"133459267","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}
Pub Date : 2019-05-07DOI: 10.1201/9780429070655-66
K. Koizumi, M. Shoji, Y. Kitagawa, H. Isobe, R. Takeda, S. Yamanaka, K. Yamaguchi
{"title":"Hybrid-DFT study on the high-valent metal-oxo bonds in manganese porphyrins and related species","authors":"K. Koizumi, M. Shoji, Y. Kitagawa, H. Isobe, R. Takeda, S. Yamanaka, K. Yamaguchi","doi":"10.1201/9780429070655-66","DOIUrl":"https://doi.org/10.1201/9780429070655-66","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"187 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"127314415","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}
Pub Date : 2019-05-07DOI: 10.1201/9780429070655-102
D. Nori-Shargh, Fatemeh-Rozita Ghizadeh, Maryam Malekhosseini, F. Deyhimi
{"title":"Configurational and Conformational Properties of Cyclododeca-1,2,7,8-tetraene: An Ab Inito Study and NBO Analysis","authors":"D. Nori-Shargh, Fatemeh-Rozita Ghizadeh, Maryam Malekhosseini, F. Deyhimi","doi":"10.1201/9780429070655-102","DOIUrl":"https://doi.org/10.1201/9780429070655-102","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"42 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"124112207","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}
Pub Date : 2019-05-07DOI: 10.1201/9780429070655-137
T. Verstraelent, D. Van Neck, P. Ayers, V. Van Speybroeck, M. Waroquier
{"title":"The Gradient Curves Method: An improved strategy for the derivation of molecular mechanics valence force fields from ab initio data","authors":"T. Verstraelent, D. Van Neck, P. Ayers, V. Van Speybroeck, M. Waroquier","doi":"10.1201/9780429070655-137","DOIUrl":"https://doi.org/10.1201/9780429070655-137","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"110 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"114599961","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}
Pub Date : 2019-05-07DOI: 10.1201/9780429070655-148
F. Batzias, C. Saridaki
{"title":"On the Determinants of Optimal Capacity of Water Treatment Plants Operating within a Network","authors":"F. Batzias, C. Saridaki","doi":"10.1201/9780429070655-148","DOIUrl":"https://doi.org/10.1201/9780429070655-148","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"85 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"114770613","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}
A. Haque, A. Jabbar, J. Khawar, Sajid Raza Chaudhary
{"title":"Role of Turbulence Modeling for Leading Edge Vortical Flow","authors":"A. Haque, A. Jabbar, J. Khawar, Sajid Raza Chaudhary","doi":"10.1201/9780429070655-7","DOIUrl":"https://doi.org/10.1201/9780429070655-7","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"9 3 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"116928785","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}
{"title":"An efficient collocation Method for Diffusion-Convection Problem with Chemical Reaction","authors":"K. Alhumaizi, M. A. Soliman","doi":"10.1201/9780429070655-4","DOIUrl":"https://doi.org/10.1201/9780429070655-4","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"9 11 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"116933446","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}
Pub Date : 2019-05-07DOI: 10.1201/9780429070655-92
J. Mateu, C. Comas, E. Porcu, J. A. López
{"title":"Probability Mapping in Cluster Spatial Processes. Computational and Analytical Solutions Through Copulas","authors":"J. Mateu, C. Comas, E. Porcu, J. A. López","doi":"10.1201/9780429070655-92","DOIUrl":"https://doi.org/10.1201/9780429070655-92","url":null,"abstract":"","PeriodicalId":350909,"journal":{"name":"Recent Progress in Computational Sciences and Engineering","volume":"36 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2019-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"123510345","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}
京公网安备 11010802042870号
京ICP备2023020795号-1
扫码关注我们
求助内容：
应助结果提醒方式：