中文版 | English

在结果中检索

KIB OpenIR

浏览/检索结果: 共10条，第1-10条 帮助

已选(0)清除 条数/页：   排序方式：
Discovery of novel modulators targeting human TRPC5: Docking-based virtual screening, molecular dynamics simulation and binding af fi nity predication 期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2021, 卷号: 102, 页码: 107795
作者:  Liu,Bin;  Zhang,Wei;  Guo,Sheng;  Zuo,Zhili
浏览  |  Adobe PDF(4277Kb)  |  收藏  |  浏览/下载：194/23  |  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  
Which species does the virus like most: Binding modes study between SARS-CoV-2 S protein and ACE2 receptor 期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2021, 卷号: 105, 页码: 107893
作者:  Guo,Sheng;  Yang,Jing;  Lei,Yu;  Liu,Bin;  Zhang,Wei;  Zhang,Li;  Zuo,Zhili
浏览  |  Adobe PDF(3681Kb)  |  收藏  |  浏览/下载：194/28  |  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 potentially biased agonists of mu-opioid receptor (MOR) through molecular docking, pharmacophore modeling, and MD simulation 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2021, 卷号: 90, 页码: 107405
作者:  Jiang,Xuan;  Li,Shuxiang;  Zhang,Hongbin;  Wang,Liang-Liang
浏览  |  Adobe PDF(6441Kb)  |  收藏  |  浏览/下载：342/40  |  提交时间：2022/04/02
mu-Opioid receptors (MOR)  Biased ligands  Molecular docking  Hip-hop pharmacophore  MD simulation  
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;  Shen, Wen;  Zhang, Shuqun;  Wang, LiangLiang;  Yang, Weimin;  Zuo, Zhili
收藏  |  浏览/下载：300/0  |  提交时间：2020/03/18
Adenylyl cyclases  Homology modeling  Consensus scoring  Molecular dynamics simulation  Virtual screening  Biological evaluation  
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;  Wang, Liangliang;  Chang, Kwen-Jen
浏览  |  Adobe PDF(1542Kb)  |  收藏  |  浏览/下载：520/101  |  提交时间：2020/03/18
delta opioid receptor agonists  3D-QSAR  Homology modeling  Molecular dynamics simulation  Molecular docking  
Phosphorus mitigation remains critical in water protection: A review and meta-analysis from one of China's most eutrophicated lakes 期刊论文
SCIENCE OF THE TOTAL ENVIRONMENT, 2019, 卷号: 689, 页码: 1336-1347
作者:  Yan, Kai;  Yuan, Zengwei;  Goldberg, Stefanie;  Gao, Wei;  Ostermann, Anne;  Xu, Jianchu;  Zhang, Fusuo;  Elser, James
收藏  |  浏览/下载：257/0  |  提交时间：2019/10/28
Lake Dianchi  Phosphorus budget  Markov chain Monte Carlo simulation  Bayesian hierarchical model  Watershed management  Geological phosphorus-rich mountains  
Discovery of novel wee1 inhibitors via structure-based virtual screening and biological evaluation 期刊论文
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN, 2018, 卷号: 32, 期号: 9, 页码: 901-915
作者:  Li, Yaping;  Pu, Yinglan;  Liu, Hui;  Zhang, Li;  Liu, Xingyong;  Li, Yan;  Zuo, Zhili
收藏  |  浏览/下载：489/0  |  提交时间：2018/11/06
Wee1 inhibitors  Pharmacophore model  Molecular docking  Virtual screening  Molecular dynamics simulation  
Oligocene climate signals and forcings in Eurasia revealed by plant macrofossil and modelling results 期刊论文
GONDWANA RESEARCH, 2018, 卷号: 61, 页码: 115-127
作者:  Li, Shufeng;  Xing, Yaowu;  Valdes, Paul J.;  Huang, Yongjiang;  Su, Tao;  Farnsworth, Alex;  Lunt, Daniel J.;  Tang, He;  Kennedy, Alan T.;  Zhou, Zhekun
收藏  |  浏览/下载：460/0  |  提交时间：2019/03/18
Oligocene  Eurasia  Paleoclimate  Fossil  Simulation  
A Spatial Simulation Model of Hydrology and Vegetation Dynamics inSemi-Permanent Prairie Wetlands 期刊论文
Ecological Applications, 1993, 卷号: 3, 期号: 2, 页码: 279-293
作者:  Karen A. Poiani;  W. Carter Johnson
Adobe PDF(555Kb)  |  收藏  |  浏览/下载：101/0  |  提交时间：2017/07/26
Climate  Distribution Of Emergent Cover And Open Water  Geographic Information System(Gis)  Prairie Wetlands  Spatial Simulation Model Of Vegetation Dynamics  Vegetation Change Vs. Waterlevel Change  Waterfowl Habitat  Wetland Hydrology  Wildlife Manageme  
Bias and Random Errors in Estimators of Net Root Production: A SimulationApproach 期刊论文
Ecology, 1984, 卷号: 65, 期号: 6, 页码: 1760-1764
作者:  J. S. Singh;  W. K. Lauenroth;  H. W. Hunt;  D. M. Swift
Adobe PDF(195Kb)  |  收藏  |  浏览/下载：88/0  |  提交时间：2017/07/26
Root Production  Simulation Modelling