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中国科学院西北高原生物研究所机构知识库
Knowledge Management System of Northwest Institute of Plateau Biology, CAS
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收录类别:SCI
发表日期:2013
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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)
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浏览/下载:945/158
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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
Computational studies on the catalytic mechanism of phosphoketolase
期刊论文
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2013, 卷号: 1025, 页码: 1-7
作者:
Zhang, Jing
;
Liu, Yongjun
;
Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Jinan 250100, Shandong, Peoples R China.
Adobe PDF(1726Kb)
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浏览/下载:584/159
  |  
提交时间:2014/05/09
Phosphoketolase
Density Functional Theory (Dft) Method
Reaction Mechanism
Thdp-dependent Enzyme
Dehydration
Keto-enol Tautomerism
Theoretical study on copper-catalyzed reaction of hydrosilane, alkyne and carbon dioxide: A hydrocarboxylation or a hydrosilylation process ?
期刊论文
JOURNAL OF ORGANOMETALLIC CHEMISTRY, 2013, 卷号: 745, 页码: 166-172
作者:
Zhao, Yi
;
Liu, Yuxia
;
Bi, Siwei
;
Liu, Yongjun
;
Bi, SW (reprint author), Qufu Normal Univ, Sch Chem & Chem Engn, Qufu 273165, Peoples R China.
Adobe PDF(1653Kb)
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浏览/下载:748/26
  |  
提交时间:2014/05/09
Hydrocarboxylation
Hydrosilylation
Sigma Bond Metathesis
Insertion
Carbon Dioxide
Dft
Theoretical Study of the Catalytic Mechanism of E1 Subunit of Pyruvate Dehydrogenase Multienzyme Complex from Bacillus stearothermophilus
期刊论文
BIOCHEMISTRY, 2013, 卷号: 52, 期号: 45, 页码: 8079-8093
作者:
Sheng, Xiang
;
Liu, Yongjun
;
Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Theoret & Computat Chem, Jinan 250100, Shandong, Peoples R China.
Adobe PDF(1038Kb)
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浏览/下载:519/116
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提交时间:2014/05/09
One-step Separation and Purification of Three Lignans and One Flavonol from Sinopodophyllum emodi by Medium-pressure Liquid Chromatography and High-speed Counter-current Chromatography
期刊论文
PHYTOCHEMICAL ANALYSIS, 2013, 卷号: 24, 期号: 6, 页码: 603-607
作者:
Wang, Ping
;
Liu, Yongling
;
Chen, Tao
;
Xu, Wenhua
;
You, Jinmao
;
Liu, Yongjun
;
Li, Yulin
Adobe PDF(448Kb)
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浏览/下载:905/197
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提交时间:2014/05/09
High-speed Counter-current Chromatography
Medium-pressure Liquid Chromatography
One-step
4 '-demethylpodophyllotoxin
Podophyllotoxin
Deoxypodophyllotoxin
Kaempferol
Sinopodophyllum Emodi
Insight into the mechanism of aminomutase reaction: A case study of phenylalanine aminomutase by computational approach
期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2013, 卷号: 46, 页码: 65-73
作者:
Wang, Kang
;
Hou, Qianqian
;
Liu, Yongjun
;
Liu, YJ (reprint author), Shandong Univ, Sch Chem & Chem Engn, Key Lab Theoret & Computat Chem Univ Shandong, Jinan 250100, Shandong, Peoples R China.
Adobe PDF(2540Kb)
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浏览/下载:468/92
  |  
提交时间:2014/05/09
Aminomutase
Density Functional Calculations
Enzymatic Reaction Mechanisms
Phenylalanine Aminomutase
Stereochemistry
A theoretical study on the halogen bonding interactions of C6F5I with a series of group 10 metal monohalides
期刊论文
JOURNAL OF MOLECULAR MODELING, 2013, 卷号: 19, 期号: 9, 页码: 3821-3829
作者:
Cheng, Na
;
Liu, Yongjun
;
Zhang, Changqiao
;
Liu, Chengbu
Adobe PDF(645Kb)
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浏览/下载:646/172
  |  
提交时间:2014/05/09
Dft
Halogen Bonds
Iodoperfluoroarenes
Metal Halide
Nbo
QM/MM study of the conversion mechanism of lysine to methylornithine catalyzed by methylornithine synthase (PylB)
期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2013, 卷号: 132, 期号: 9
作者:
Zhu, Wenyou
;
Liu, Yongjun
;
Zhang, Rui
;
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(628Kb)
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浏览/下载:510/120
  |  
提交时间:2014/05/09
Lysine
Methylornithine
Reaction Mechanism
Qm/mm
Methylornithine Synthase (Pylb)
Theoretical study on the proton shuttle mechanism of saccharopine dehydrogenase
期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2013, 卷号: 44, 页码: 17-25
作者:
Sheng, Xiang
;
Gao, Jun
;
Liu, Yongjun
;
Liu, Chengbu
Adobe PDF(2598Kb)
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浏览/下载:981/155
  |  
提交时间:2014/05/09
Saccharopine Dehydrogenase
L-lysine Biosynthesis
Density Functional Theory (Dft) Method
Proton Shuttle
Reaction Mechanism
Theoretical study on the deglycosylation mechanism of rice BGlu1 beta-glucosidase
期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2013, 卷号: 113, 期号: 8, 页码: 1071-1075
作者:
Wang, Jinhu
;
Hou, Qianqian
;
Sheng, Xiang
;
Gao, Jun
;
Liu, Yongjun
;
Liu, Chengbu
;
Wang, JH (reprint author), Shandong Univ, Sch Chem & Chem Engn, Minist Educ, Key Lab Colloid & Interface Chem, Jinan 250100, Shandong, Peoples R China.
Adobe PDF(581Kb)
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浏览/下载:524/137
  |  
提交时间:2014/05/09
Qm
Mm
Deglycosylation
-glucosidases
Laminaribiose
Reaction Mechanism