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
上海药物研究所 [4]
长春应用化学研究所 [4]
大连化学物理研究所 [3]
化学研究所 [2]
自动化研究所 [2]
生态环境研究中心 [2]
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OAI收割 [23]
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期刊论文 [20]
会议论文 [2]
学位论文 [1]
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2021 [2]
2018 [3]
2017 [3]
2015 [2]
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Biochemist... [3]
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交叉与边缘领域的力学... [1]
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Structural basis for molecular recognition of G protein-coupled estrogen receptor by selected bisphenols
期刊论文
OAI收割
SCIENCE OF THE TOTAL ENVIRONMENT, 2021, 卷号: 793, 页码: -
作者:
Liu, Xiuchang
;
Xue, Qiao
;
Zhang, Huazhou
;
Fu, Jianjie
;
Zhang, Aiqian
  |  
收藏
  |  
浏览/下载:26/0
  |  
提交时间:2022/01/04
Structure-dependent GPER binding
Molecular recognition mechanism
Induced-fit effect
Molecular dynamics simulations
Bisphenols
Glycan Epitopes and Potential Glycoside Antagonists of DC-SIGN Involved in COVID-19: In Silico Study
期刊论文
OAI收割
BIOMOLECULES, 2021, 卷号: 11, 期号: 11, 页码: 16
作者:
Gao, Meina
;
Li, Hui
;
Ye, Chenghao
;
Chen, Kaixian
;
Jiang, Hualiang
  |  
收藏
  |  
浏览/下载:76/0
  |  
提交时间:2022/01/04
DC-SIGN
glycan epitopes
carbohydrate recognition mechanism
natural glycoside antagonists
molecular dynamics simulations
COVID-19
Characterization of the interaction interface and conformational dynamics of human TGIF1 homeodomain upon the binding of consensus DNA
期刊论文
OAI收割
BIOCHIMICA ET BIOPHYSICA ACTA-PROTEINS AND PROTEOMICS, 2018, 卷号: 1866, 期号: 10, 页码: 1021-1028
作者:
Li, Shuangli
;
Hu, Rui
;
Yao, Haijie
;
Long, Dong
;
Luo, Fan
  |  
收藏
  |  
浏览/下载:62/0
  |  
提交时间:2018/11/05
TG interacting factor-1
DNA recognition
Interaction interface
Conformational dynamics
NMR spectroscopy
Recent Trends and Applications of Molecular Modeling in GPCR-Ligand Recognition and Structure-Based Drug Design
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 2018, 卷号: 19, 期号: 7
作者:
Yuan, Xiaojing
;
Xu, Yechun
  |  
收藏
  |  
浏览/下载:31/0
  |  
提交时间:2019/01/08
GPCR
receptor-ligand recognition
drug design
molecular modeling
molecular dynamics
docking
binding affinity
binding pathway
Comparing NMR and X-ray protein structure: Lindemann-like parameters and NMR disorder
期刊论文
OAI收割
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2018, 卷号: 36, 期号: 9, 页码: 2331-2341
作者:
Sussman, JL
;
Faraggi, E
;
Dunker, AK
;
Kloczkowski, A
  |  
收藏
  |  
浏览/下载:102/0
  |  
提交时间:2018/12/27
BACKBONE TORSION ANGLES
MAJOR URINARY PROTEIN
INTRINSIC DISORDER
STRUCTURE PREDICTION
SECONDARY STRUCTURE
CRYSTAL-STRUCTURE
DYNAMICS
DIFFRACTION
CRYSTALLOGRAPHY
RECOGNITION
雌激素受体α介导信号通路关键环节分子机制的计算研究
学位论文
OAI收割
北京: 中国科学院生态环境研究中心, 2017
作者:
曹慧明
  |  
收藏
  |  
浏览/下载:347/0
  |  
提交时间:2018/06/22
配体结合
雌激素受体α信号通路
分子动力学模拟
辅因招募
Erα-mediated Signaling Pathway
受体响应元件识别
Molecular Dynamics Simulations
Ligand Binding
Cofactor Recruitment
Ere Recognition
A salt-bridge switch in the molecular recognition between RS receptor and RGD ligand from the ABEEM sigma pi molecular dynamics simulations
期刊论文
OAI收割
MOLECULAR SIMULATION, 2017, 卷号: 43, 期号: 13-16, 页码: 1045-1055
作者:
Yu, Ling
;
Yang, Zhong-Zhi
;
Zhang, Chao
;
Zhao, Dong-Xia
;
Wang, Qian
  |  
收藏
  |  
浏览/下载:34/0
  |  
提交时间:2019/06/20
Molecular Dynamics
Flexible Recognition
Polarisation Signal
Water-bridge
Binding Free Energy
Modeling Temporal Dynamics and Spatial Configurations of Actions Using Two-Stream Recurrent Neural Networks
会议论文
OAI收割
Honolulu, Hawai, July 22 - July 25 2017
作者:
Wang Hongsong(王洪松)
;
Wang Liang(王亮)
;
Liang Wang
  |  
收藏
  |  
浏览/下载:57/0
  |  
提交时间:2018/01/03
Action Recognition
Temporal Dynamics
Spatial Configurations
Interlayer Water Regulates the Bio-nano Interface of a beta-sheet Protein stacking on Graphene
期刊论文
OAI收割
Scientific Reports, 2015, 卷号: 5
W. P.
;
Xu Lv, G. J.
;
Zhang, H. Y.
;
Li, X.
;
Liu, S. J.
;
Niu, H.
;
Xu, D. S.
;
Wu, R. A.
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2015/05/08
molecular-dynamics
carbon nanotubes
liquid water
adsorption
surfaces
recognition
peptides
simulations
binding
nanomaterials
Nonlinear Dynamics Recognition in Solar Time Series Based on Recurrence Plot Techniques
会议论文
OAI收割
2nd International Conference on Information Science and Control Engineering, Shanghai, PEOPLES R CHINA, 2015-04-24
作者:
Deng LH(邓林华)
收藏
  |  
浏览/下载:59/0
  |  
提交时间:2016/10/11
information processing
time series analysis
nonlinear dynamics recognition
cross-recurrence plot