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
计算技术研究所 [10]
采集方式
OAI收割 [10]
内容类型
期刊论文 [10]
发表日期
2024 [1]
2022 [2]
2021 [2]
2020 [4]
2019 [1]
学科主题
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Artificial intelligence and computer-aided drug discovery: Methods development and application
期刊论文
OAI收割
METHODS, 2024, 卷号: 231, 页码: 55-56
作者:
Zhang, Haiping
;
Wei, Yanjie
;
Saravanan, Konda Mani
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2024/12/06
DeepBindBC: A practical deep learning method for identifying native-like protein-ligand complexes in virtual screening
期刊论文
OAI收割
METHODS, 2022, 卷号: 205, 页码: 247-262
作者:
Zhang, Haiping
;
Zhang, Tingting
;
Saravanan, Konda Mani
;
Liao, Linbu
;
Wu, Hao
  |  
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2023/07/12
Native like protein-ligand
Drug virtual screening
ResNet
Deep learning
Human pancreatic alpha amylase inhibitor
An Efficient Modern Strategy to Screen Drug Candidates Targeting RdRp of SARS-CoV-2 With Potentially High Selectivity and Specificity
期刊论文
OAI收割
FRONTIERS IN CHEMISTRY, 2022, 卷号: 10, 页码: 13
作者:
Zhang, Haiping
;
Gong, Xiaohua
;
Peng, Yun
;
Saravanan, Konda Mani
;
Bian, Hengwei
  |  
收藏
  |  
浏览/下载:38/0
  |  
提交时间:2022/12/07
antiviral agent
RdRp
compound specificity estimation
virtual screening
tubeimoside III
An Integrated Deep Learning and Molecular Dynamics Simulation-Based Screening Pipeline Identifies Inhibitors of a New Cancer Drug Target TIPE2
期刊论文
OAI收割
FRONTIERS IN PHARMACOLOGY, 2021, 卷号: 12, 页码: 13
作者:
Zhang, Haiping
;
Li, Junxin
;
Saravanan, Konda Mani
;
Wu, Hao
;
Wang, Zhichao
  |  
收藏
  |  
浏览/下载:31/0
  |  
提交时间:2022/06/21
TIPE2
UM-164
virtual screening
deep learning
molecular dynamics simulation
Identifying the miRNA Signature Association with Aging-Related Senescence in Glioblastoma
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 2021, 卷号: 22, 期号: 2, 页码: 14
作者:
Gnanavel, Mutharasu
;
Murugesan, Akshaya
;
Konda Mani, Saravanan
;
Yli-Harja, Olli
;
Kandhavelu, Meenakshisundaram
  |  
收藏
  |  
浏览/下载:34/0
  |  
提交时间:2021/12/01
glioblastoma
microRNA
senescence
molecular signaling
biochemical pathways
A novel virtual screening procedure identifies Pralatrexate as inhibitor of SARS-CoV-2 RdRp and it reduces viral replication in vitro
期刊论文
OAI收割
PLOS COMPUTATIONAL BIOLOGY, 2020, 卷号: 16, 期号: 12, 页码: 20
作者:
Zhang, Haiping
;
Yang, Yang
;
Li, Junxin
;
Wang, Min
;
Saravanan, Konda Mani
  |  
收藏
  |  
浏览/下载:37/0
  |  
提交时间:2021/12/01
Transcriptomic analysis of glioblastoma multiforme providing new insights into GPR17 signaling communication
期刊论文
OAI收割
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2020, 页码: 14
作者:
Mutharasu, Gnanavel
;
Murugesan, Akshaya
;
Konda Mani, Saravanan
;
Yli-Harja, Olli
;
Kandhavelu, Meenakshisundaram
  |  
收藏
  |  
浏览/下载:49/0
  |  
提交时间:2020/12/10
GPR17
signaling networks
glioblastoma multiforme
RNA-Seq
protein–
protein interface
kinases
Structural basis for the inhibition of SARS-CoV2 main protease by Indian medicinal plant-derived antiviral compounds
期刊论文
OAI收割
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2020, 页码: 9
作者:
Saravanan, Konda Mani
;
Zhang, Haiping
;
Senthil, Renganathan
;
Vijayakumar, Kevin Kumar
;
Sounderrajan, Vignesh
  |  
收藏
  |  
浏览/下载:29/0
  |  
提交时间:2020/12/10
SARS-CoV2
main protease
medicinal plants
molecular docking and dynamics
drug design
Deep Learning Based Drug Screening for Novel Coronavirus 2019-nCov
期刊论文
OAI收割
INTERDISCIPLINARY SCIENCES-COMPUTATIONAL LIFE SCIENCES, 2020, 页码: 9
作者:
Zhang, Haiping
;
Saravanan, Konda Mani
;
Yang, Yang
;
Hossain, Md Tofazzal
;
Li, Junxin
  |  
收藏
  |  
浏览/下载:42/0
  |  
提交时间:2020/12/10
Coronavirus
Deep learning
Drug screening
Homology modeling
3C-like protease
A novel machine learning based approach for iPS progenitor cell identification
期刊论文
OAI收割
PLOS COMPUTATIONAL BIOLOGY, 2019, 卷号: 15, 期号: 12, 页码: 19
作者:
Zhang, Haishan
;
Shao, Ximing
;
Peng, Yin
;
Teng, Yanning
;
Saravanan, Konda Mani
  |  
收藏
  |  
浏览/下载:30/0
  |  
提交时间:2020/12/10