机构

• 大连化学物理研究所 [11]

采集方式

• OAI收割 [11]

内容类型

• 期刊论文 [11]

发表日期

• 2018 [2]
• 2017 [2]
• 2009 [1]
• 2007 [3]
• 2006 [3]

学科主题

筛选

浏览/检索结果: 共11条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 The effect of benzo-annelation on intermolecular hydrogen bond and proton transfer of 2-methyl-3-hydroxy-4(1H)-quinolone in methanol: A TD-DFT study 期刊论文  OAI收割 JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2018, 卷号: 31, 期号: 5 作者:  Ma, Xiaoguang;  Bao, Dongshuai;  Zhao, Yanliang;  Wang, Meishan;  Zhou, Panwang   |  收藏  |  浏览/下载：36/0  |  提交时间：2019/06/20 Electronic Spectra  Excited-state Proton Transfer  Hydrogen Bond  Transition State   Mechanism of Fluorescence Quenching by Acylamino Twist in the Excited State for 1-(Acylamino)anthraquinones 期刊论文  OAI收割 JOURNAL OF PHYSICAL CHEMISTRY A, 2018, 卷号: 122, 期号: 11, 页码: 2864-2870 作者:  Zhou, Panwang;  Liu, Yan;  Yang, Yunfan;  Yang, Chuanlu;  Zhao, Yanliang   |  收藏  |  浏览/下载：34/0  |  提交时间：2019/06/20 Concerted Mechanisms of Excited-State Proton Intramolecular Transfer for Bis-2,4-(2-benzoxazolyl)-hydroquinone and Its Derivatives 期刊论文  OAI收割 JOURNAL OF PHYSICAL CHEMISTRY A, 2017, 卷号: 121, 期号: 43, 页码: 8217-8226 作者:  Yang, Chuanlu;  Ma, Xiaoguang;  Bao, Dongshuai;  Wang, Meishan;  Yang, Yunfan 收藏  |  浏览/下载：18/0  |  提交时间：2017/12/19 Concerted Mechanisms of Excited-State Proton Intramolecular Transfer for Bis-2,4-(2-benzoxazolyl)-hydroquinone and Its Derivatives 期刊论文  OAI收割 JOURNAL OF PHYSICAL CHEMISTRY A, 2017, 卷号: 121, 期号: 43, 页码: 8217-8226 作者:  Yang, Chuanlu;  Wang, Meishan;  Bao, Dongshuai;  Ma, Xiaoguang;  Yang, Yunfan 收藏  |  浏览/下载：23/0  |  提交时间：2017/12/19 Theoretical study of N-dealkylation of N-cyclopropyl-N-methylaniline catalyzed by cytochrome P450: insight into the origin of the regioselectivity 期刊论文  OAI收割 dalton transactions, 2009, 期号: 2, 页码: 291-297 作者:  Li, Dongmei;  Wang, Yong;  Yang, Chuanlu;  Han, Keli 收藏  |  浏览/下载：21/0  |  提交时间：2015/11/12 Theoretical study of the stereodynamics of the reactions of D-+H-2 -> H-+HD and H-+D-2 -> D-+HD 期刊论文  OAI收割 chemical physics, 2007, 卷号: 337, 期号: 1-3, 页码: 93-98 作者:  Li, Wen Liang;  Wang, Mei Shan;  Yang, Chuanlu;  Liu, Wenwang;  Sun, Chao 收藏  |  浏览/下载：24/0  |  提交时间：2015/11/11 stereodynamics of the reaction  quasi-classical trajectory theory  differential cross-section  vector relation   Theoretical study of N-demethylation of substituted N,N-dimethylanilines by cytochrome P450: The mechanistic significance of kinetic isotope effect profiles 期刊论文  OAI收割 journal of physical chemistry b, 2007, 卷号: 111, 期号: 26, 页码: 7700-7710 作者:  Wang, Yong;  Kumar, Devesh;  Yang, Chuanlu;  Han, Keli;  Shaik, Sason 收藏  |  浏览/下载：23/0  |  提交时间：2015/11/11 A new mechanism for ethanol oxidation mediated by cytochrome P450 2E1: Bulk polarity of the active site makes a difference 期刊论文  OAI收割 chembiochem, 2007, 卷号: 8, 期号: 3, 页码: 277-281 作者:  Wang, Yong;  Yang, Chuanlu;  Wang, Hongming;  Han, Keli;  Shaik, Sason 收藏  |  浏览/下载：15/0  |  提交时间：2010/11/30 cytochrome P450  density functional calculations  enzyme catalysis  heme proteins  oxygenation   Density functional theory investigation of product distribution following reaction of acrylonitrile on diamond (001)-2x1 surface 期刊论文  OAI收割 journal of physical chemistry b, 2006, 卷号: 110, 期号: 46, 页码: 23395-23402 作者:  Zhang, Laibin;  Ren, Tingqi;  Wang, Hongming;  Wang, Meishan;  Yang, Chuanlu 收藏  |  浏览/下载：28/0  |  提交时间：2015/11/11 The molecular structure and vibrational spectra of corrolazine metal complexes (CzM) by density functional theory 期刊论文  OAI收割 spectrochimica acta part a-molecular and biomolecular spectroscopy, 2006, 卷号: 64, 期号: 3, 页码: 795-800 作者:  Wang, Hongming;  Yang, Chuanlu;  Zhang, Zhihong;  Wang, Meishan;  Han, Keli 收藏  |  浏览/下载：21/0  |  提交时间：2010/11/30 vibrations  DFT  corrolazine  molecular structure