Chinese | English

Search in the results

KIB OpenIR

Browse/Search Results:  1-10 of 51 Help

Selected(0)Clear Items/Page:    Sort:
Discovery of novel inhibitors against main protease (Mpro) of SARS-CoV-2 via virtual screening and biochemical evaluation 期刊论文
BIOORGANIC CHEMISTRY, 2021, 卷号: 110, 页码: 104767
Authors:  Guo,Sheng;  Xie,Hang;  Lei,Yu;  Liu,Bin;  Zhang,Li;  Xu,Yechun;  Zuo,Zhili
Adobe PDF(3181Kb)  |  Favorite  |  View/Download：23/2  |  Submit date：2022/04/02
SARS-CoV-2  Main protease  Virtual screening  Biochemical evaluation  
Microbial transformation of diosgenin to diosgenone by Wickerhamomyces anomalus JQ-1 obtained from Naxi traditional Jiu Qu 期刊论文
BIOORGANIC CHEMISTRY, 2020
Authors:  Li, Liangqun;  Zhao, Yanqiang;  Lang, Bayi;  Xie, Yuying;  Meng, Manfred Shaowu;  He, Yun;  Yang, Lixin;  Liu, Aizhong
Adobe PDF(2142Kb)  |  Favorite  |  View/Download：43/11  |  Submit date：2021/01/05
Identification of Novel TRPC5 Inhibitors by Pharmacophore-Based and Structure-Based Approaches 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2020
Authors:  Li, Shuxiang;  Zhang, Shuqun;  Chen, Dingyuan;  Jiang, Xuan;  Liu, Bin;  Zhang, Hongbin;  Rachakunta, Munikishore;  Zuo, Zhili
Adobe PDF(4261Kb)  |  Favorite  |  View/Download：54/15  |  Submit date：2021/01/05
Computational simulation studies on the binding selectivity of Wee1 and Checkpoint kinase 1 by molecular dynamics simulation combined with free energy calculations 期刊论文
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2020
Authors:  Li, Yaping;  Liu, Xingyong;  Zhang, Shuqun;  Wang, Liangliang;  Zhang, Li;  Zuo, Zhili
Adobe PDF(2066Kb)  |  Favorite  |  View/Download：64/11  |  Submit date：2021/01/05
Homology modeling and 3D-QSAR study of benzhydrylpiperazine delta opioid receptor agonists 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2019, 卷号: 83, 页码: 9
Authors:  Pan, Chenling;  Meng, Hao;  Zhang, Shuqun;  Zuo, Zhili;  Shen, Yuehai;  Wang, Liangliang;  Chang, Kwen-Jen
Adobe PDF(1542Kb)  |  Favorite  |  View/Download：96/23  |  Submit date：2020/03/18
delta opioid receptor agonists  3D-QSAR  Homology modeling  Molecular dynamics simulation  Molecular docking  
Hepatoprotective steroids from roots of Cynanchum otophyllum 期刊论文
FITOTERAPIA, 2019, 卷号: 136, 页码: 7
Authors:  Dong, Jinrun;  Peng, Xingrong;  Lu, Shuangyang;  Zhou, Lin;  Qiu, Minghua
Adobe PDF(466Kb)  |  Favorite  |  View/Download：87/18  |  Submit date：2019/08/19
Cynanchum otophyllum  Asclepiadaceae  Steriods  Anti-liver fibrosis activity  
多聚苄类化合物对褪黑素受体的激动活性与构效关系研究 学位论文
硕士: 中国科学院昆明植物研究所, 2019
Authors:  陈思月
Adobe PDF(5429Kb)  |  Favorite  |  View/Download：15/0  |  Submit date：2022/08/29
褪黑素受体  天麻多聚苄酚  构效关系  分子对接  
Identification of novel monoamine oxidase selective inhibitors employing a hierarchical ligand-based virtual screening strategy 期刊论文
FUTURE MEDICINAL CHEMISTRY, 2019, 卷号: 11, 期号: 8, 页码: 801-816
Authors:  Wang, Dong;  Li, Zhaoyang;  Liu, Yi;  Chen, Mo;  Chen, Nianhang;  Zuo, Zhili;  Kong, De-Xin
Adobe PDF(1462Kb)  |  Favorite  |  View/Download：92/14  |  Submit date：2019/09/10
BRS-3D  monoamine oxidase selective inhibitors  virtual screening  
Identification of potential AMPK activator by pharmacophore modeling, molecular docking and QSAR study 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2019, 卷号: 79, 页码: 165-176
Authors:  Li, Yingying;  Peng, Jiale;  Li, Penghua;  Du, Haibo;  Li, Yaping;  Liu, Xingyong;  Zhang, Li;  Wang, Liang-Liang;  Zuo, Zhili
Adobe PDF(7335Kb)  |  Favorite  |  View/Download：127/16  |  Submit date：2019/07/29
Pharmacophore modeling  Molecular docking  Quantitative structure activity relationship (QSAR)  Molecular dynamics  AMPK  Activator  
Discovery of novel indoleamine 2,3-dioxygenase 1 (IDO1) inhibitors by virtual screening 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2019, 卷号: 78, 页码: 306-316
Authors:  Zhou, Yeheng;  Peng, Jiale;  Li, Penghua;  Du, Haibo;  Li, Yaping;  Li, Yingying;  Zhang, Li;  Sun, Wei;  Liu, Xingyong;  Zuo, Zhili
Adobe PDF(2732Kb)  |  Favorite  |  View/Download：143/15  |  Submit date：2019/03/25
IDO1  Molecular docking  HipHop pharmacophore  3D-QSAR  PAINS