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 [15]
昆明植物研究所 [5]
过程工程研究所 [5]
大连化学物理研究所 [4]
上海生物化学与细胞生... [3]
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OAI收割 [42]
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期刊论文 [44]
学位论文 [1]
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2025 [1]
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A Novel Nitrite Reductase from
Acinetobacter haemolyticus
for Efficient Degradation of Nitrite
期刊论文
OAI收割
BIOMOLECULES, 2025, 卷号: 15, 期号: 1, 页码: 11
作者:
Yin, Xiao-Yan
;
Bonku, Emmanuel Mintah
;
Yuan, Jian-Feng
;
Yang, Zhong-Hua
  |  
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2025/04/01
nitrite reductase
Acinetobacter haemolyticus
nitrite reduction
homology modeling
Which species does the virus like most: Binding modes study between SARS-CoV-2 S protein and ACE2 receptor
期刊论文
OAI收割
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2021, 卷号: 105, 页码: 107893
作者:
  |  
收藏
  |  
浏览/下载:34/0
  |  
提交时间:2022/04/02
SARS-CoV-2
COVID-19
Homology modeling
Molecular dynamics simulation
Binding free energy
CORONAVIRUS SPIKE PROTEIN
ACTIVATION
GROMACS
ENTRY
Discovery of novel modulators targeting human TRPC5: Docking-based virtual screening, molecular dynamics simulation and binding af fi nity predication
期刊论文
OAI收割
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2021, 卷号: 102, 页码: 107795
作者:
Liu,Bin
;
Zhang,Wei
;
Guo,Sheng
;
Zuo,Zhili
  |  
收藏
  |  
浏览/下载:44/0
  |  
提交时间:2022/04/02
hTRPC5
Homology modeling
Molecular docking
Molecular dynamics simulation
Virtual screening
INHIBITOR
CHANNELS
GROMACS
POTENT
AMBER
IDENTIFICATION
CONSTRAINTS
INTEGRATION
AMYGDALA
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:43/0
  |  
提交时间:2020/12/10
Coronavirus
Deep learning
Drug screening
Homology modeling
3C-like protease
Synthesis, antifungal activity and potential mechanism of fusidic acid derivatives possessing amino-terminal groups
期刊论文
OAI收割
FUTURE MEDICINAL CHEMISTRY, 2020, 卷号: 12, 期号: 9, 页码: 763-774
作者:
Cao, Yucheng
;
Ni, Jingxuan
;
Ji, Wentao
;
Shang, Kangle
;
Liang, Kaicheng
  |  
收藏
  |  
浏览/下载:47/0
  |  
提交时间:2020/12/24
antifungal activity
fusidic acid
homology modeling
molecular docking
molecular dynamics simulations
Discovery of a potent and selective adenylyl cyclase type 8 agonist by docking-based virtual screening
期刊论文
OAI收割
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:44/0
  |  
提交时间:2020/03/18
Adenylyl cyclases
Homology modeling
Consensus scoring
Molecular dynamics simulation
Virtual screening
Biological evaluation
Simulative structure and binding sites of lyral with olfactory receptor 10J5 using computational prediction methods
期刊论文
OAI收割
JOURNAL OF TOXICOLOGY AND ENVIRONMENTAL HEALTH-PART A-CURRENT ISSUES, 2020, 卷号: 83, 期号: 1, 页码: 1-8
作者:
Wang, P (Wang, Pu)[ 1 ]
;
Zhang, R (Zhang, Rui)[ 2,3 ]
;
Yu, SB (Yu, Shunbang)[ 1 ]
;
Lee, C (Lee, Charles)[ 4 ]
;
Wang, H (Wang, He)[ 1 ]
  |  
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2020/03/16
Homology modeling
ligand docking
binding sites
olfactory receptor
lyral
Homology modeling and 3D-QSAR study of benzhydrylpiperazine delta opioid receptor agonists
期刊论文
OAI收割
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:34/0
  |  
提交时间:2020/03/18
delta opioid receptor agonists
3D-QSAR
Homology modeling
Molecular dynamics simulation
Molecular docking
杜氏藻属和假单胞菌的碳酸酐酶与金属间的相互作用研究
学位论文
OAI收割
北京: 中国科学院大学, 2019
作者:
Syed Muhammad Iqbal Azimuddin
  |  
收藏
  |  
浏览/下载:54/0
  |  
提交时间:2021/12/10
耐盐性碳酸酐酶
同源建模
汞结合蛋白
泛基因组分析
锌金属相互作用
汞毒性
细胞外聚合物
Halotolerant Carbonic anhydrase
homology modeling
Mercury binding proteins
pan genomic analysis
Zinc metal interaction
Mercury Toxicity
Extra Cellular polymeric substance
Characterization of lhsorp5cs, a gene catalyzing proline synthesis in oriental hybrid lily sorbonne: molecular modelling and expression analysis
期刊论文
iSwitch采集
Botanical studies, 2017, 卷号: 58, 期号: 1
作者:
Wang,Le
;
Guo,Zhihong
;
Zhang,Yubao
;
Wang,Yajun
;
Yang,Guo
收藏
  |  
浏览/下载:52/0
  |  
提交时间:2019/05/09
Lhsorp5cs gene
Homology modeling
Proline
Abiotic stress
Lilium spp.