中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海药物研究所 [8]
西北高原生物研究所 [1]
采集方式
OAI收割 [9]
内容类型
期刊论文 [9]
发表日期
2023 [3]
2022 [2]
2021 [1]
2020 [1]
2017 [1]
2015 [1]
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学科主题
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Drug repurposing and structure-based discovery of new PDE4 and PDE5 inhibitors
期刊论文
OAI收割
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2023, 卷号: 262, 页码: 14
作者:
Liu, Jiayuan
;
Zhang, Xianglei
;
Chen, Guofeng
;
Shao, Qiang
;
Zou, Yi
  |  
收藏
  |  
浏览/下载:32/0
  |  
提交时间:2024/01/16
Phosphodiesterase-4 (PDE4)
PDE5
Inhibitor
Drug repurposing
Crystal structure
Structure -guided optimization
MEDIATE-Molecular DockIng at homE: Turning collaborative simulations into therapeutic solutions
期刊论文
OAI收割
EXPERT OPINION ON DRUG DISCOVERY, 2023, 页码: 13
作者:
Vistoli, Giulio
;
Manelfi, Candida
;
Talarico, Carmine
;
Fava, Anna
;
Warshel, Arieh
  |  
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2023/10/17
Collaborative computing
virtual screening
docking simulations
drug repurposing
SARS-CoV-2
artificial intelligence
ETCM v2.0: An update with comprehensive resource and rich annotations for traditional Chinese medicine
期刊论文
OAI收割
ACTA PHARMACEUTICA SINICA B, 2023, 卷号: 13, 期号: 6, 页码: 2559-2571
作者:
Zhang, Yanqiong
;
Li, Xin
;
Shi, Yulong
;
Chen, Tong
;
Xu, Zhijian
  |  
收藏
  |  
浏览/下载:58/0
  |  
提交时间:2023/10/17
Traditional Chinese medicine
Database
Target identification
Network visualization
New drug research and development
Molecular mechanism
Quality marker
Drug repurposing
Novel niclosamide-derived adjuvants elevating the efficacy of polymyxin B against MDR Pseudomonas aeruginosa DK2
期刊论文
OAI收割
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2022, 卷号: 236, 页码: 114318
作者:
Lu, Taotao
;
Zheng, Xinyu
;
Mao, Fei
;
Cao, Qiao
;
Cao, Qin
  |  
收藏
  |  
浏览/下载:28/0
  |  
提交时间:2024/03/21
Pseudomonas aeruginosa DK2
Polymyxin B
Niclosamide
Adjuvants
Drug repurposing
Drug repurposing for cancer treatment through global propagation with a greedy algorithm in a multilayer network
期刊论文
OAI收割
CANCER BIOLOGY & MEDICINE, 2022, 卷号: 19, 期号: 1, 页码: 74-+
作者:
Cheng, Xi
;
Zhao, Wensi
;
Zhu, Mengdi
;
Wang, Bo
;
Wang, Xuege
  |  
收藏
  |  
浏览/下载:271/0
  |  
提交时间:2024/03/21
Database
drug repurposing
machine learning
network random walk
proteomics analysis
DeepDRK: a deep learning framework for drug repurposing through kernel-based multi-omics integration
期刊论文
OAI收割
BRIEFINGS IN BIOINFORMATICS, 2021, 卷号: 22, 期号: 5
作者:
Wang, Yongcui
;
Yang, Yingxi
;
Chen, Shilong
;
Wang, Jiguang
  |  
收藏
  |  
浏览/下载:40/0
  |  
提交时间:2021/11/18
drug repurposing
multi-omics data sources
kernel-based data integration
machine learning
cancer precision medicine
Identify potent SARS-CoV-2 main protease inhibitors via accelerated free energy perturbation-based virtual screening of existing drugs
期刊论文
OAI收割
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2020, 卷号: 117, 期号: 44, 页码: 27381-27387
作者:
Li, Zhe
;
Li, Xin
;
Huang, Yi-You
;
Wu, Yaoxing
;
Liu, Runduo
  |  
收藏
  |  
浏览/下载:95/0
  |  
提交时间:2020/12/24
virtual screening
SARS-CoV-2
drug repurposing
free energy perturbation
main protease
A systematic analysis of FDA-approved anticancer drugs
期刊论文
OAI收割
BMC SYSTEMS BIOLOGY, 2017, 卷号: 11, 页码: 27-43
作者:
Sun, Jingchun
;
Wei, Qiang
;
Zhou, Yubo
;
Wang, Jingqi
;
Liu, Qi
  |  
收藏
  |  
浏览/下载:28/0
  |  
提交时间:2019/01/08
Anticancer drugs
Drug-cancer network
Cancer-drug-target network
Drug repurposing
Computational Drug Repositioning for Cancer Therapeutics
期刊论文
OAI收割
CURRENT TOPICS IN MEDICINAL CHEMISTRY, 2015, 卷号: 15, 期号: 8, 页码: 767-775
作者:
Jiao, Mingkun
;
Liu, Gang
;
Xue, Yu
;
Ding, Chunyong
  |  
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2019/01/08
Anticancer drugs
Cancer therapeutics
Computational drug repositioning
Drug discovery
Drug repositioning
Drug repurposing