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中国医学科学院 北... [17]
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期刊论文 [17]
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2019 [2]
2018 [4]
2017 [3]
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专题:中国医学科学院 北京协和医学院
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Network pharmacology study of traditional Chinese medicines for stroke treatment and effective constituents screening
期刊论文
2019, 卷号: 242, 页码: 112044
作者:
Ren, Liwen
;
Zheng, Xiangjin
;
Liu, Jinyi
;
Li, Wan
;
Fu, Weiqi
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2020/01/03
Stroke
TCMs
Data mining
Network pharmacology
Virtual screening
OGDR
Docking- and pharmacophore-based virtual screening for the identification of novel Mycobacterium tuberculosis protein tyrosine phosphatase B (MptpB) inhibitor with a thiobarbiturate scaffold
期刊论文
2019, 卷号: 85, 页码: 229-239
作者:
Zhang, Dongfeng
;
Lin, Yun
;
Chen, Xi
;
Zhao, Wenting
;
Chen, Dongni
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2020/01/03
Tuberculosis
MptpB inhibitor
Virtual screening
Docking
Pharmacophore
Thiobarbiturate scaffold
The discovery of novel HDAC3 inhibitors via virtual screening and in vitro bioassay
期刊论文
2018, 卷号: 33, 期号: 1, 页码: 525-535
作者:
Xia, Jie
;
Hu, Huabin
;
Xue, Wenjie
;
Wang, Xiang Simon
;
Wu, Song
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2020/01/03
Histone deacetylase 3
virtual screening
pose filter
in vitro bioassay
novel inhibitors
Virtual Screening of Small Molecular Inhibitors against DprE1
期刊论文
2018, 卷号: 23, 期号: 3
作者:
Zhang, Gang
;
Guo, Song
;
Cui, Huaqing
;
Qi, Jianguo
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2020/01/03
DprE1
virtual screening
tuberculosis
ADMET
In silico approach in reveal traditional medicine plants pharmacological material basis
期刊论文
2018, 卷号: 13, 页码: 33
作者:
Yi, Fan
;
Li, Li
;
Xu, Li-jia
;
Meng, Hong
;
Dong, Yin-mao
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2020/01/03
Traditional medicinal plants
Virtual screening
Network pharmacology
Medicinal plants information analytics
Pharmacological basis
In silico approaches to identify novel myeloid cell leukemia-1 (Mcl-1) inhibitors for treatment of cancer
期刊论文
2018, 卷号: 36, 期号: 9, 页码: 2424-2435
作者:
Ren, Ji-Xia
;
Li, Cheng-Ping
;
Zhou, Xiu-Ling
;
Cao, Xue-Song
;
Xie, Yong
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2020/01/03
Mcl-1
pharmacophore
3D QSAR
molecular docking
virtual screening
A Thoroughly Validated Virtual Screening Strategy for Discovery of Novel HDAC3 Inhibitors
期刊论文
2017, 卷号: 18, 期号: 1
作者:
Hu, Huabin
;
Xia, Jie
;
Wang, Dongmei
;
Wang, Xiang Simon
;
Wu, Song
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2020/01/03
HDAC3 inhibitors
anti-diabetes
virtual screening
MUBD-HDACs
benchmarking calculation
Virtual Screening against Phosphoglycerate Kinase 1 in Quest of Novel Apoptosis Inhibitors
期刊论文
2017, 卷号: 22, 期号: 6
作者:
Xia, Jie
;
Feng, Bo
;
Shao, Qianhang
;
Yuan, Yuhe
;
Wang, Xiang Simon
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2020/01/04
apoptosis
phosphoglycerate kinase 1
terazosin
virtual screening
Parkinson's disease
The discovery of a novel compound with potent antitumor activity: virtual screening, synthesis, biological evaluation and preliminary mechanism study
期刊论文
2017, 卷号: 8, 期号: 15, 页码: 24635-24643
作者:
Jin Yuanyuan
;
Li Linhu
;
Yang Zhaoyong
;
Liu Mingliang
;
Guo Huiyuan
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2020/01/04
anti-tumor
synthesis
virtual screening
farnesyltransferase inhibitor
Discovery of Influenza A virus neuraminidase inhibitors using support vector machine and Na < ve Bayesian models
期刊论文
2016, 卷号: 20, 期号: 2, 页码: 439-451
作者:
Lian, Wenwen
;
Fang, Jiansong
;
Li, Chao
;
Pang, Xiaocong
;
Liu, Ai-Lin
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2020/01/04
Influenza virus
Neuraminidase inhibitor
Support vector machine
Naive Bayesian
Virtual screening
H1N1
H3N2
SVM
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