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科研机构
长春应用化学研究所 [17]
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期刊论文 [17]
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2015 [1]
2013 [5]
2012 [2]
2011 [1]
2010 [2]
2009 [2]
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专题:长春应用化学研究所
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The Universal Statistical Distributions of the Affinity, Equilibrium Constants, Kinetics and Specificity in Biomolecular Recognition
期刊论文
plos computational biology, 2015, 卷号: 11, 期号: 4, 页码: 5493-5497
作者:
Zheng,Xiliang
;
Wang,Jin
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2016/05/12
SINGLE-MOLECULE DYNAMICS
RANDOM-ENERGY-MODEL
PROTEIN-FOLDING FUNNELS
3-HELIX BUNDLE PROTEIN
DRUG DISCOVERY
COMBINATORIAL TECHNOLOGIES
ENZYMATIC DYNAMICS
INTERFACE BINDING
LANDSCAPE MODEL
LIGAND-BINDING
Pocket-Based Drug Design: Exploring Pocket Space
期刊论文
aaps journal, 2013, 卷号: 15, 期号: 1, 页码: 228-241
Zheng XL
;
Gan LF
;
Wang EK
;
Wang J
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2014/04/18
PROTEIN-LIGAND-BINDING
SMALL-MOLECULE BINDING
STRUCTURAL BASIS
TARGET FLEXIBILITY
TRANSIENT POCKETS
SITE PREDICTION
NORMAL-MODES
RAS PROTEIN
IN-SILICO
DRUGGABILITY
Rational Drug Design: The Search for Ras Protein Hydrolysis Intermediate Conformation Inhibitors with Both Affinity and Specificity
期刊论文
current pharmaceutical design, 2013, 卷号: 19, 期号: 12, 页码: 2246-2258
Zheng XL
;
Liu ZJ
;
Li D
;
Wang EK
;
Wang J
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2014/04/20
EMPIRICAL SCORING FUNCTIONS
SMALL-MOLECULE INHIBITOR
SELF-ORGANIZING MAP
MARKETED ORAL-DRUGS
LIGAND INTERACTIONS
FLEXIBLE DOCKING
AUTOMATED DOCKING
BINDING-AFFINITY
GENETIC ALGORITHM
COMPOUND COLLECTIONS
A novel self-assembly with zinc porphyrin coordination polymer for enhanced photocurrent conversion in supramolecular solar cells
期刊论文
electrochimica acta, 2013, 卷号: 112, 页码: 515-521
Cao J
;
Liu JC
;
Deng WT
;
Lib RZ
;
Jin NZ
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2014/04/14
EFFICIENCY
SENSITIZERS
PERFORMANCE
COPPER(II)
COMPLEXES
FULLERENE
SPECTRA
BINDING
DESIGN
LIGAND
Exploring the Dynamic Functional Landscape of Adenylate Kinase Modulated by Substrates
期刊论文
journal of chemical theory and computation, 2013, 卷号: 9, 期号: 1, 页码: 84-95
Wang Y
;
Gan LF
;
Wang EK
;
Wang J
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2014/04/18
CONFORMATIONAL TRANSITIONS
ENERGY LANDSCAPE
INDUCED-FIT
ESCHERICHIA-COLI
MOLECULAR-DYNAMICS
LIGAND-BINDING
DOMAIN CLOSURE
NETWORK MODEL
PROTEIN
MECHANISM
Optimizing Scoring Function of Protein-Nucleic Acid Interactions with Both Affinity and Specificity
期刊论文
plos one, 2013, 卷号: 8, 期号: 9, 页码: 文献号: e74443
Yan ZQ
;
Wang J
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  |  
浏览/下载:15/0
  |  
提交时间:2014/04/15
KNOWLEDGE-BASED POTENTIALS
COMPUTATIONAL REDESIGN
DOCKING BENCHMARK
MEAN FORCE
MOLECULAR RECOGNITION
BINDING-AFFINITY
DNA INTERACTIONS
ENERGY FUNCTION
LIGAND-BINDING
DATA-BANK
Probing the Interaction of Cisplatin with Cytochrome c by Electrospray Ionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry
期刊论文
analytical chemistry, 2012, 卷号: 84, 期号: 14, 页码: 6206-6212
Zhang NB
;
Du YG
;
Cui M
;
Xing JP
;
Liu ZQ
;
Liu SY
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2013/05/20
PROTEIN-LIGAND INTERACTIONS
ANTICANCER PLATINUM DRUGS
COPPER CHAPERONE ATOX1
HYDROGEN-EXCHANGE
TOP-DOWN
CONFORMATIONAL DYNAMICS
SERUM-PROTEINS
BINDING-SITES
COMPLEXES
ESI
Exploration of Multi-State Conformational Dynamics and Underlying Global Functional Landscape of Maltose Binding Protein
期刊论文
plos computational biology, 2012, 卷号: 8, 期号: 4, 页码: 文献号: e1002471
Wang Y
;
Tang C
;
Wang EK
;
Wang J
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2013/10/09
INDUCED STRUCTURAL-CHANGES
UNITED-RESIDUE MODEL
INDUCED-FIT
ADENYLATE KINASE
LIGAND-BINDING
MOLECULAR-DYNAMICS
ENERGY LANDSCAPES
BETA-CYCLODEXTRIN
ACTIVE-TRANSPORT
SINGLE-MOLECULE
Observation of slow magnetic relaxation in triple-stranded lanthanide helicates
期刊论文
dalton transactions, 2011, 卷号: 40, 期号: 32, 页码: 8213-8217
Lin SY
;
Xu GF
;
Zhao L
;
Guo YN
;
Guo Y
;
Tang JK
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2012/06/11
X-RAY-STRUCTURE
SUPRAMOLECULAR COMPLEXES
LIGAND
SINGLE
DELOCALIZATION
LUMINESCENCE
SUBSTITUENT
POLYMERS
EDIFICES
BINDING
Praseodymium(III)-based bis-metallacalix[4]arene with host-guest behaviour
期刊论文
dalton transactions, 2010, 卷号: 39, 期号: 18, 页码: 4353-4357
Xu GF
;
Gamez P
;
Teat SJ
;
Tang JK
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2012/06/06
HIGH-SPIN MOLECULES
STRUCTURAL-CHARACTERIZATION
COORDINATION CHEMISTRY
LANTHANIDE COMPLEXES
MAGNETIC-PROPERTIES
MACROCYCLIC LIGAND
HYDROXO COMPLEXES
CLUSTERS
POLYMERS
BINDING
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