机构

• 大连化学物理研究所 [13]

采集方式

• OAI收割 [13]

内容类型

• 期刊论文 [13]

发表日期

• 2014 [2]
• 2013 [1]
• 2012 [4]
• 2011 [1]
• 2010 [1]
• 2006 [2]
• 更多

学科主题

• 物理化学 [1]

筛选

浏览/检索结果: 共13条，第1-10条 帮助 限定条件 专题：大连化学物理研究所    第一署名单位    第一作者单位    通讯作者单位     条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序题名升序题名降序作者升序作者降序发表日期升序发表日期降序 Development and perspective in vanadium flow battery modeling 期刊论文  OAI收割 applied energy, 2014, 卷号: 132, 页码: 254-266 作者:  Zheng, Qiong;  Li, Xianfeng;  Cheng, Yuanhui;  Ning, Guiling;  Xing, Feng 收藏  |  浏览/下载：20/0  |  提交时间：2015/11/13 Vanadium flow battery  Modeling approach  Modeling application   Herb-drug interaction prediction based on the high specific inhibition of andrographolide derivatives towards UDP-glucuronosyltransferase (UGT) 2B7 期刊论文  OAI收割 toxicology and applied pharmacology, 2014, 卷号: 277, 期号: 1, 页码: 86-94 作者:  Ma, Hai-Ying;  Sun, Dong-Xue;  Cao, Yun-Feng;  Ai, Chun-Zhi;  Qu, Yan-Qing 收藏  |  浏览/下载：26/0  |  提交时间：2015/11/17 Andrographolide derivatives  Herb-drug interaction (HDI)  UDP-glucuronosyltransferases (UGTs)  Adverse effects   3D-QSAR and pharmacophore model study on aryl diphenolic azoles as estrogen receptor-beta ligands 期刊论文  OAI收割 medicinal chemistry research, 2013, 卷号: 22, 期号: 9, 页码: 4468-4480 作者:  Luo, Hua-Jun;  Zou, Kun;  Huang, Nian-Yu;  Wang, Jun-Zhi;  Deng, Wei-Qiao 收藏  |  浏览/下载：21/0  |  提交时间：2015/11/09 Pharmacophore  3D-QSAR  Estrogen receptor-beta  Prediction   Tree-based ensemble methods and their applications in analytical chemistry 期刊论文  OAI收割 trac-trends in analytical chemistry, 2012, 卷号: 40, 页码: 158-167 作者:  Cao, Dong-Sheng;  Xu, Qing-Song;  Zhang, Liang-Xiao;  Huang, Jian-Hua;  Liang, Yi-Zeng 收藏  |  浏览/下载：19/0  |  提交时间：2015/11/09 Chemometrics  Classification and regression tree (CART)  Cluster analysis  Complex data  Ensemble algorithm  Kernel method  Outlier detection  Pattern analysis  Tree-based ensemble  Variable selection   A Novel Chemometric Method for the Prediction of Human Oral Bioavailability 期刊论文  OAI收割 international journal of molecular sciences, 2012, 卷号: 13, 期号: 6, 页码: 6964-6982 作者:  Xu, Xue;  Zhang, Wuxia;  Huang, Chao;  Li, Yan;  Yu, Hua 收藏  |  浏览/下载：71/0  |  提交时间：2015/11/13 oral bioavailability  quantitative structure activity relationship  cytochrome P4503A4 and P4502D6  P-glycoprotein   Kernel k-nearest neighbor algorithm as a flexible SAR modeling tool 期刊论文  OAI收割 chemometrics and intelligent laboratory systems, 2012, 卷号: 114, 页码: 19-23 作者:  Cao, Dong-Sheng;  Huang, Jian-Hua;  Yan, Jun;  Zhang, Liang-Xiao;  Hu, Qian-Nan 收藏  |  浏览/下载：16/0  |  提交时间：2015/11/13 k-nearest neighbor (k-NN)  Kernel methods  String kernel  Structure-activity relationship (SAR)   Exploring the structure requirement for KC theta inhibitory activity of pyridinecarbonitrile derivatives: an in silico analysis 期刊论文  OAI收割 journal of molecular graphics & modelling, 2012, 卷号: 34, 页码: 76-88 作者:  Li, Yan;  Hao, Ming;  Ren, Hong;  Zhang, Shuwei;  Wang, Xia 收藏  |  浏览/下载：27/0  |  提交时间：2013/10/11 Protein kinase C theta  CoMFA  CoMSIA  3D-QSAR  Molecular docking  Molecular dynamics   Isolation, biological evaluation and 3D-QSAR studies of insecticidal/narcotic sesquiterpene polyol esters 期刊论文  OAI收割 journal of molecular modeling, 2011, 卷号: 17, 期号: 4, 页码: 681-693 作者:  Wei, Shao-peng;  Ji, Zhi-qin;  Zhang, Hui-xiao;  Zhang, Ji-wen;  Wang, Yong-hua 收藏  |  浏览/下载：55/0  |  提交时间：2015/11/12 Sesquiterpene polyol esters  Isolation  Insecticide  3D-QSAR   Experimental and modeling study on water dynamic transport of the proton exchange membrane fuel cell under transient air flow and load change 期刊论文  OAI收割 journal of power sources, 2010, 卷号: 195, 期号: 19, 页码: 6629-6636 作者:  Qu, Shuguo;  Li, Xiaojin;  Ke, Changchun;  Shao, Zhi-Gang;  Yi, Baolian 收藏  |  浏览/下载：13/0  |  提交时间：2010/11/30 Proton exchange membrane fuel cell  Transient response  Water transport  Transient air flow change  Load change   Prediction of Saccharomyces cerevisiae growth phenotypes based on elementary flux mode analysis 期刊论文  OAI收割 chemical journal of chinese universities-chinese, 2006, 卷号: 27, 期号: 9, 页码: 1683-1685 作者:  Jiang Da;  Wang Yong-Hua;  Li Yan;  Zhang Shu-Wei;  Yang Sheng-Li 收藏  |  浏览/下载：14/0  |  提交时间：2015/11/11 prediction  elementary flux mode  Saccharomyces cerevisiae  growth phenotype