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Influence of Chirality of Crizotinib on Its MTH1 Protein Inhibitory Activity: Insight from Molecular Dynamics Simulations and Binding Free Energy Calculations [期刊论文]
PLOS ONE, 2015, 卷号: 10, 期号: 12
Niu, YZ;  Pan, DB;  Shi, DF;  Bai, QF;  Liu, HX;  Yao, XJ(姚小军)
View/Download:3/0
 
Computational study on the inhibition mechanism of a cyclic peptide MaD5 to PfMATE: Insight from molecular dynamics simulation, free energy calculation and dynamical network analysis [期刊论文]
CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS, 2015, 卷号: 149, 页码: 81-88
Jin, XJ;  Bai, QF;  Xue, WW;  Liu, HX;  Yao, XJ(姚小军)
View/Download:4/0
 
Secovironolide, a novel furanosteroid scaffold with a five-membered B ring from the endophytic fungus Talaromyces wortmannii LGT-4 [期刊论文]
TETRAHEDRON LETTERS, 2015, 卷号: 56, 期号: 48, 页码: 6754-6757
Ding, HE;  Yang, ZD;  Sheng, L;  Zhou, SY;  Li, S;  Yao, XJ(姚小军);  Zhi, KK;  Wang, YG;  Zhang, F
View/Download:4/0
 
Unveiling the molecular mechanism of brassinosteroids: Insights from structure-based molecular modeling studies [期刊论文]
STEROIDS, 2015, 卷号: 104, 页码: 111-117
Lei, BL;  Liu, JY;  Yao, XJ(姚小军)
View/Download:6/0
 
Significant improvement of phenothiazine organic dye-sensitized solar cell performance using dithiafulvenyl unit as additional donor [期刊论文]
ORGANIC ELECTRONICS, 2015, 卷号: 27, 页码: 107-113
Wan, ZQ;  Jia, CY;  Wang, Y;  Luo, JS;  Yao, XJ(姚小军)
View/Download:2/0
 
Influence of interface structures on the properties of molybdenum disulfide/graphene composites: A density functional theory study [期刊论文]
JOURNAL OF ALLOYS AND COMPOUNDS, 2015, 卷号: 649, 页码: 961-967
Zan, WY;  Geng, W;  Liu, HX;  Yao, XJ(姚小军)
View/Download:4/0
 
Characterization of the binding of shikonin to human immunoglobulin using scanning electron microscope, molecular modeling and multi-spectroscopic methods [期刊论文]
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2015, 卷号: 150, 页码: 514-522
He, WY;  Ye, XY;  Yao, XJ(姚小军);  Wu, XL;  Lin, Q;  Huang, GL;  Hua, YJ;  Hui, Y
View/Download:3/0
 
New nor-ursane type triterpenoids from Gelsemium elegans [期刊论文]
FITOTERAPIA, 2015, 卷号: 106, 页码: 175-183
Wu, HR;  He, XF;  Jin, XJ;  Pan, H;  Shi, ZN;  Xu, DD;  Yao, XJ(姚小军);  Zhu, Y
View/Download:2/0
 
Naked-Eye and Near-Infrared Fluorescence Probe for Hydrazine and Its Applications in In Vitro and In Vivo Bioimaging [期刊论文]
ANALYTICAL CHEMISTRY, 2015, 卷号: 87, 期号: 17, 页码: 9101-9107
Zhang, JJ;  Ning, LL;  Liu, JT;  Wang, JX;  Yu, BF;  Liu, XY;  Yao, XJ(姚小军);  Zhang, ZP;  Zhang, HX(张海霞)
View/Download:3/0
 
In Silico Identification of Protein S-Palmitoylation Sites and Their Involvement in Human Inherited Disease [期刊论文]
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2015, 卷号: 55, 期号: 9, 页码: 2015-2025
Li, SY;  Li, JZ;  Ning, LL;  Wang, SP;  Niu, YZ;  Jin, NZ;  Yao, XJ(姚小军);  Liu, HX;  Xi, LL
View/Download:1/0
 

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