兰州大学机构库

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Druggable negative allosteric site of P2X3 receptors 期刊论文
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2018, 卷号: 115, 期号: 19, 页码: 4939-4944
Authors:  Wang, J;  Wang, Y;  Cui, WW;  Huang, YC;  Yang, Y;  Liu, Y;  Zhao, WS;  Cheng, XY;  Sun, WS;  Cao, P...Wang, J;  Wang, Y;  Cui, WW;  Huang, YC;  Yang, Y;  Liu, Y;  Zhao, WS;  Cheng, XY;  Sun, WS;  Cao, P;  Zhu, MX;  Wang, R;  Hattori, M;  Yu, Y;  Hattori, M (reprint author), Fudan Univ, Collaborat Innovat Ctr Genet & Dev, Sch Life Sci, Dept Physiol & Biophys,State Key Lab Genet Engn, Shanghai 200438, Peoples R China.;  Yu, Y (reprint author), Shanghai Jiao Tong Univ, Sch Med, Inst Med Sci, Dept Pharmacol & Chem Biol, Shanghai 200025, Peoples R China.;  Wang, R (reprint author), Lanzhou Univ, Sch Basic Med Sci, Key Lab Preclin Study New Drugs Gansu Prov, Lanzhou 730000, Gansu, Peoples R China.;  Yu, Y (reprint author), Chinese Acad Sci, Shanghai Inst Mat Med, State Key Lab Drug Res, Shanghai 200025, Peoples R China.
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P2X3 receptors  allosteric inhibition  X-ray crystallography  AF-219  AF-353  
JAK2激酶和SMO受体的分子动力学模拟及药物设计 学位论文
硕士, 兰州: 兰州大学, 2017
Authors:  李姣姣
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抑制剂  分子对接  分子动力学模拟  MM-GBSA  作用机制  
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
Authors:  Jin, XJ;  Bai, QF;  Xue, WW;  Liu, HX;  Yao, XJ(姚小军);  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, State Key Lab Appl Organ Chem, Lanzhou 730000, Peoples R China.
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PfMATE  Molecular dynamics simulation  Free energy calculation  Dynamical network analysis  
Exploring the stability of long intergenic non-coding RNA in K562 cells by comparative studies of RNA-Seq datasets 期刊论文
BIOLOGY DIRECT, 2014, 卷号: 9, 页码: -
Authors:  Wang, L;  Zhou, DQ;  Tu, J;  Wang, Y;  Lu, ZH;  Lu, ZH (reprint author), Southeast Univ, Sch Biol Sci & Med Engn, State Key Lab Bioelect, Sipailou 2, Nanjing 210096, Jiangsu, Peoples R China.
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Rna Sequencing (Rna-seq)  Long Intergenic Non-coding Rnas (lincRnas)  K562  Rna Stability  
HIV-1整合体与药物相互作用的分子模拟研究 学位论文
博士, 兰州: 兰州大学, 2014
Authors:  薛伟伟
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HIV-1  整合酶  整合体  耐药性  INSTIs  LEDGINs  同源模建  分子对接  分子动力学模拟  结合自由能计算  
Nematicidal metabolites from roots of Stellera chamaejasme against Bursaphelenchus xylophilus and Bursaphelenchus mucronatus 期刊论文
PEST MANAGEMENT SCIENCE, 2014, 卷号: 70, 期号: 5
Authors:  Cui, HY;  Jin, H;  Liu, Q;  Yan, ZQ;  Ding, L;  Qin, B;  Qin, B (reprint author), Chinese Acad Sci, Lanzhou Inst Chem Phys, Key Lab Chem North Western Plant Resources, Lanzhou 730000, Peoples R China.
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phytochemical  Bursaphelenchus mucronatus  Bursaphelenchus xylophilus  Stellera chamaejasme  nematicidal metabolite  
Molecular modeling and residue interaction network studies on the mechanism of binding and resistance of the HCV NS5B polymerase mutants to VX-222 and ANA598 期刊论文
ANTIVIRAL RESEARCH, 2014, 卷号: 104
Authors:  Xue, WW;  Jiao, PZ;  Liu, HX;  Yao, XJ(姚小军);  Yao, XJ (reprint author), Lanzhou Univ, State Key Lab Appl Organ Chem, Dept Chem, Lanzhou 730000, Peoples R China.
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HCV NS5B polymerase  Mutation-induced drug resistance  Molecular docking  MD simulation  Binding free energy calculation  Residue interaction network  
Palladium-triggered deprotection chemistry for protein activation in living cells 期刊论文
NATURE CHEMISTRY, 2014, 卷号: 6, 期号: 4
Authors:  Li, J;  Yu, JT;  Zhao, JY;  Wang, J;  Zheng, SQ;  Lin, SX;  Chen, L;  Yang, MY;  Jia, S;  Zhang, XY...Li, J;  Yu, JT;  Zhao, JY;  Wang, J;  Zheng, SQ;  Lin, SX;  Chen, L;  Yang, MY;  Jia, S;  Zhang, XY;  Chen, PR;  Li, J (reprint author), Peking Univ, Key Lab Bioorgan Chem & Mol Engn, Synthet & Funct Biomol Ctr, Beijing Natl Lab Mol Sci,Minist Educ,Coll Chem &, Beijing 100871, Peoples R China.
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Molecular Modeling Study on the Allosteric Inhibition Mechanism of HIV-1 Integrase by LEDGF/p75 Binding Site Inhibitors 期刊论文
PLOS ONE, 2014, 卷号: 9, 期号: 3
Authors:  Xue, WW;  Liu, HX;  Yao, XJ(姚小军);  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, State Key Lab Appl Organ Chem, Lanzhou 730000, Peoples R China.
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Computational Study on the Inhibitor Binding Mode and Allosteric Regulation Mechanism in Hepatitis C Virus NS3/4A Protein 期刊论文
PLOS ONE, 2014, 卷号: 9, 期号: 2
Authors:  Xue, WW;  Yang, Y(杨瑛);  Wang, XT;  Liu, HX;  Yao, XJ(姚小军);  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, State Key Lab Appl Organ Chem, Lanzhou 730000, Peoples R China.
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