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The adsorption behavior and mechanism of Cr(VI) on 3D hierarchical alpha-Fe2O3 structures exposed by (001) and non-(001) planes 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2017, 卷号: 309, 页码: 815-823
作者:  Liu, Zhong;  Yu, Ruitao;  Dong, Yaping;  Li, Wu;  Lv, Baoliang
收藏  |  浏览/下载：199/0  |  提交时间：2017/02/15
Alpha-fe2o3  Plane  Cr(Vi)  Adsorption  Mechanism  
Theoretical study of the hydrolysis mechanism of 2-pyrone-4,6-dicarboxylate (PDC) catalyzed by LigI 期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2015, 卷号: 61, 页码: 21-29
作者:  Zhang, Shujun;  Ma, Guangcai;  Liu, Yongjun;  Ling, Baoping
浏览  |  Adobe PDF(3500Kb)  |  收藏  |  浏览/下载：282/119  |  提交时间：2015/12/17
Ligi  2-pyrone-4  6-dicarboxylate Lactonase  Qm/mm  2-pyrone-4  Hydrolysis Mechanism  6-dicarboxylate (Pdc)  
Simultaneous Removal of Toxic Cyanide and Cu(II) Ions from Wastewater by a Bi-functional Raspberry-like TiO2@yeast Microspheres 期刊论文
JOURNAL OF ADVANCED OXIDATION TECHNOLOGIES, 2015, 卷号: 18, 期号: 2, 页码: 175-184
作者:  Li, Hong-Ying;  Bai, Bo;  Jing, Deng-Wei;  Ding, Chen-Xu;  Wang, Hong-Lun;  Suo, You-Rui
收藏  |  浏览/下载：171/0  |  提交时间：2015/12/17
Photocatalysis  Bio-adsorption  Hybrid Materials  Synergistic Mechanism  
Ring Contraction Catalyzed by the Metal-Dependent Radical SAM Enzyme: 7-Carboxy-7-deazaguanine Synthase from B. multivorans. Theoretical Insights into the Reaction Mechanism and the Influence of Metal Ions 期刊论文
ACS CATALYSIS, 2015, 卷号: 5, 期号: 7, 页码: 3953-3965
作者:  Zhu, Wenyou;  Liu, Yongjun
收藏  |  浏览/下载：165/0  |  提交时间：2015/12/17
7-carboxy-7-deazaguanine Synthase (Quee)  Reaction Mechanism  7-carboxy-7-deazaguanine (Cdg)  Qm/mm  6-carboxy-5  Sam Radical Enzyme  6  7  8-tetrahydropterin (Cph4)  
A QM/MM study of the reaction mechanism of (R)-hydroxynitrile lyases from Arabidopsis thaliana (AtHNL) 期刊论文
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2015, 卷号: 83, 期号: 1, 页码: 66-77
作者:  Zhu, WY;  Liu, YJ;  Zhang, R;  Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Jinan 250100, Shandong, Peoples R China.
浏览  |  Adobe PDF(928Kb)  |  收藏  |  浏览/下载：233/113  |  提交时间：2015/12/17
R-selective Hnl Enzyme  Asymmetric Synthesis  Catalytic Mechanism  Theoretical Study  Chiral Cyanohydrins  Hydrocyanic Acid  
Untangling interacting mechanisms of seed mass variation with elevation: insights from the comparison of inter-specific and intra-specific studies on eastern Tibetan angiosperm species 期刊论文
PLANT ECOLOGY, 2015, 卷号: 216, 期号: 2, 页码: 283-292
作者:  Qi, W;  Bu, HY;  Cornelissen, JHC;  Zhang, CH;  Guo, SQ;  Wang, JH;  Zhou, XH;  Li, WJ;  Du, GZ;  Du, GZ (reprint author), Lanzhou Univ, Sch Life Sci, State Key Lab Grassland & Agroecosyst, Lanzhou 730000, Peoples R China.
浏览  |  Adobe PDF(470Kb)  |  收藏  |  浏览/下载：482/86  |  提交时间：2015/12/17
Energy-constraint Mechanism  Life Form  Pollination System  Seed Dispersal Mode  "stress-tolerance" Mechanism  Tibetan Plateau  
A QM/MM study of the catalytic mechanism of aspartate ammonia lyase 期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2014, 卷号: 51, 页码: 113-119
作者:  Zhang, Jing;  Liu, Yongjun
浏览  |  Adobe PDF(2157Kb)  |  收藏  |  浏览/下载：376/88  |  提交时间：2014/12/19
Aspartate Ammonia Lyase  Qm/mm  Mutation  Reaction Mechanism  L-aspartate  
Theoretical Investigation on the Dissociation of (R)-Benzoin Catalyzed by Benzaldehyde Lyase 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2014, 卷号: 114, 期号: 6, 页码: 375-382
作者:  Zhang, Jing;  Sheng, Xiang;  Hou, QianQian;  Liu, Yongjun
浏览  |  Adobe PDF(858Kb)  |  收藏  |  浏览/下载：425/117  |  提交时间：2014/12/19
Benzaldehyde Lyase  Density Functional Theory Method  Reaction Mechanism  Thdp-dependent Enzyme  R-benzoin  
A Density Functional Theory Study on the Catalytic Mechanism of Hydroxycinnamoyl-CoA Hydratase-Lyase 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2014, 卷号: 114, 期号: 4, 页码: 249-254
作者:  Ma, Guangcai;  Li, Yulin;  Wei, Lixin;  Liu, Yongjun;  Liu, Chengbu
浏览  |  Adobe PDF(708Kb)  |  收藏  |  浏览/下载：393/111  |  提交时间：2014/12/19
Hydroxycinnamoyl-coa Hydratase-lyase  Density Functional Theory Method  Catalytic Mechanism  Substrate Specificity  
QM/MM study on the catalytic mechanism of cyclohexane-1,2-dione hydrolase (CDH) 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2013, 卷号: 133, 期号: 2
作者:  Zhu, Wenyou;  Liu, Yongjun;  Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Colloid & Interface Chem, Minist Educ, Jinan 250100, Shandong, Peoples R China.
Adobe PDF(693Kb)  |  收藏  |  浏览/下载：933/154  |  提交时间：2014/05/09
Cyclohexane-1  Reaction Mechanism  2-dione (Cdo)  Cyclohexane-1  Qm/mm  2-dione Hydrolase (Cdh)  Thiamine Diphosphate (Thdp)-dependent Enzyme