中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海应用物理研究所 [2]
长春应用化学研究所 [2]
金属研究所 [1]
福建物质结构研究所 [1]
上海生物化学与细胞生... [1]
采集方式
OAI收割 [7]
内容类型
期刊论文 [7]
发表日期
2018 [3]
2015 [1]
2013 [1]
2011 [1]
2009 [1]
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Structural insight into precursor tRNA processing by yeast ribonuclease P
期刊论文
OAI收割
SCIENCE, 2018, 卷号: 362, 期号: 6415, 页码: 657-+
作者:
Lan, Pengfei
;
Chen, Juan
;
Shi, Shaohua
;
Wu, Jian
;
Lei, Ming
  |  
收藏
  |  
浏览/下载:43/0
  |  
提交时间:2019/04/28
Pre-transfer-rna
Density-functional Thermochemistry
Particle Electron Cryomicroscopy
Free-energy Calculations
Metal-binding Site
Molecular-dynamics
Crystal-structure
Active-site
Biological Applications
2-metal-ion Mechanism
Infrared Spectra of the SO2F2- Anion in Solid Argon and Neon
期刊论文
OAI收割
JOURNAL OF PHYSICAL CHEMISTRY A, 2018, 卷号: 122, 期号: 38, 页码: 7723-7729
作者:
Wei, R
;
Chen, XT
;
Gong, Y
  |  
收藏
  |  
浏览/下载:33/0
  |  
提交时间:2019/12/17
DENSITY-FUNCTIONAL THEORY
ION-MOLECULE REACTIONS
MATRIX-ISOLATION
THEORETICAL INVESTIGATIONS
VIBRATIONAL FREQUENCIES
POLYFLUORIDE ANIONS
SULFUR-FLUORIDE
RARE-GASES
COMPLEXES
THERMOCHEMISTRY
Investigate the Binding of Catechins to Trypsin Using Docking and Molecular Dynamics Simulation
期刊论文
OAI收割
plos one, 2015, 卷号: 10, 期号: 5, 页码: 5994-5998
作者:
Cui,Fengchao
;
Yang,Kecheng
;
Li,Yunqi
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2016/05/20
DENSITY-FUNCTIONAL THERMOCHEMISTRY
GREEN TEA POLYPHENOLS
ALPHA-AMYLASE
SERUM-ALBUMIN
LUNG-CANCER
FORCE-FIELD
INHIBITORS
PROTEIN
EXCHANGE
ENERGY
Probing the structural, electronic and magnetic properties of multicenter Fe2S2 (0/-), Fe3S4 (0/-) and Fe4S4 (0/-) clusters
期刊论文
OAI收割
Journal of Molecular Modeling, 2013, 卷号: 19, 期号: 4, 页码: 1527-1536
L. P. Ding
;
X. Y. Kuang
;
P. Shao
;
M. M. Zhong
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2013/12/24
Fe-S cluster
Photoelectron spectroscopy
Density functional theory
Magnetic properties
iron-sulfur proteins
absorption-fine-structure
photoelectron-spectroscopy
correlation-energy
gas-phase
density
thermochemistry
approximation
molecules
spectra
Spectroscopic, Electrochemical, and DFT Studies of Oxo-Centered Triruthenium Cluster Complexes with a Bis(tridentate) Triazine Ligand
期刊论文
OAI收割
European Journal of Inorganic Chemistry, 2011, 期号: 14, 页码: 2306-2316
F. R. Dai
;
Y. H. Wu
;
L. Y. Zhang
;
B. Li
;
L. X. Shi
;
Z. N. Chen
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2012/06/06
Ruthenium
Cluster compounds
N ligands
Redox chemistry
Density
functional calculations
density-functional thermochemistry
trinuclear ruthenium complex
polarizable continuum model
effective core potentials
mixed-valence
chemistry
redox behavior
electronic communication
molecular
calculations
reversible multistep
excitation-energies
Chemical Bonding and Electronic Structure of 4d-Metal Monosulfides
期刊论文
OAI收割
journal of cluster science, 2009, 卷号: 20, 期号: 3, 页码: 525-534
Sun XB
;
Wang JP
;
Wu ZJ
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2010/05/04
TRANSITION-METAL SULFIDES
FUNCTIONAL THEORY CALCULATIONS
INFRARED-SPECTRA
YTTRIUM MONOSULFIDE
DIPOLE MOMENTS
DENSITY
ZRS
THERMOCHEMISTRY
SPECTROSCOPY