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科研机构
昆明植物研究所 [23]
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期刊论文 [23]
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2020 [6]
2019 [6]
2018 [5]
2017 [3]
2016 [2]
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Chemistry [2]
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Discovery of a potent and selective adenylyl cyclase type 8 agonist by docking-based virtual screening
期刊论文
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2020, 卷号: 30, 期号: 2, 页码: 7
作者:
Weng, Zhiying
;
Xu, Guowei
;
Chen, Dingyuan
;
Yang, Yaqing
;
Song, Gao
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2020/03/18
Adenylyl cyclases
Homology modeling
Consensus scoring
Molecular dynamics simulation
Virtual screening
Biological evaluation
Discovery of highly functionalized 5,6-seco-grayanane diterpenoids as potent competitive PTP1B inhibitors
期刊论文
ORGANIC CHEMISTRY FRONTIERS, 2020
作者:
Zhou, Junfei
;
Zuo, Zhili
;
Liu, Junjun
;
Zhang, Hanqi
;
Zheng, Guijuan
收藏
  |  
浏览/下载:88/0
  |  
提交时间: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
作者:
Li, Yaping
;
Liu, Xingyong
;
Zhang, Shuqun
;
Wang, Liangliang
;
Zhang, Li
收藏
  |  
浏览/下载:52/0
  |  
提交时间:2021/01/05
Identification of Novel TRPC5 Inhibitors by Pharmacophore-Based and Structure-Based Approaches
期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2020
作者:
Li, Shuxiang
;
Zhang, Shuqun
;
Chen, Dingyuan
;
Jiang, Xuan
;
Liu, Bin
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  |  
浏览/下载:17/0
  |  
提交时间:2021/01/05
The discovery, design and synthesis of potent agonists of adenylyl cyclase type 2 by virtual screening combining biological evaluation
期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2020
作者:
Xu, Guowei
;
Yang, Yaqing
;
Yang, Yanming
;
Song, Gao
;
Li, Shanshan
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  |  
浏览/下载:21/0
  |  
提交时间:2021/01/05
Design and synthesis of novel artemisinin hybrids with potent activities against human colorectal cancer cells in vitro and in vivo (vol 182, 111665, 2019)
期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2020
作者:
Wang, Liang-Liang
;
Kong, Lingmei
;
Liu, Hui
;
Zhang, Yunqin
;
Zhang, Li
收藏
  |  
浏览/下载:8/0
  |  
提交时间: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
作者:
Pan, Chenling
;
Meng, Hao
;
Zhang, Shuqun
;
Zuo, Zhili
;
Shen, Yuehai
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2020/03/18
delta opioid receptor agonists
3D-QSAR
Homology modeling
Molecular dynamics simulation
Molecular docking
Design, synthesis and biological evaluation of novel copper-chelating acetylcholinesterase inhibitors with pyridine and N-benzylpiperidine fragments
期刊论文
BIOORGANIC CHEMISTRY, 2019, 卷号: 93, 页码: 13
作者:
Zhou, Yeheng
;
Sun, Wei
;
Peng, Jiale
;
Yan, Hui
;
Zhang, Li
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2020/03/18
Acetylcholinesterase
Drug design
N-acylhydrazone
Dementia
Copper-chelating
N-Benzylpiperidine
Design and synthesis of novel artemisinin derivatives with potent activities against colorectal cancer in vitro and in vivo
期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2019, 卷号: 182, 页码: 10
作者:
Wang, Liang-Liang
;
Kong, Lingmei
;
Liu, Hui
;
Zhang, Yunqin
;
Zhang, Li
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2020/03/02
Artemisinin
Quinazoline
Hybridization
Colorectal cancer
Chemotherapy
Ensemble docking-based virtual screening toward identifying inhibitors against Wee1 kinase
期刊论文
FUTURE MEDICINAL CHEMISTRY, 2019, 卷号: 11, 期号: 15, 页码: 1889-1906
作者:
Li, Yaping
;
Wu, Dong-mei
;
Kong, Ling-mei
;
Zhang, Shuqun
;
Du, Haibo
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2020/03/26
bioassay
ensemble docking
scoring function
virtual screening
Wee1 inhibitors
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