兰州大学机构库

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Virtual screening and activity evaluation of human uric acid transporter 1 (hURAT1) inhibitors 期刊论文
RSC Advances, 2023, 卷号: 13, 期号: 6, 页码: 3474-3486
Authors:  Yang, Yacong;  Hu, Yu;  Yao, Fengli;  Yang, Jinbo;  Ge, Leilei;  Wang, Peng;  Xu, Ximing
Adobe PDF(3612Kb)  |  Favorite  |    Submit date:2023/04/12
Bioactivity  Cytology  Molecular dynamics  Organic acids  Product design  Virtual reality  Activity evaluations  Binding mechanisms  Biological evaluation  Cell biology  Critical amino acids  Dynamics simulation  Hyperuricemia  Renal excretion  Uric acids  Virtual Screening  
Selected ideal natural ligand against TNBC by inhibiting CDC20, using bioinformatics and molecular biology 期刊论文
Aging-US, 2021, 卷号: 13, 期号: 20, 页码: 23702-23725
Authors:  Liu, Naimeng;  Wang, Xinhui;  Zhu, Zhu;  Li, Duo;  Lv, Xiaye;  Chen, Yichang;  Xie, Haoqun;  Guo, Zhen;  Song, Dong
Favorite  |    Submit date:2021/12/15
CDC20  drug development  virtual screening  TNBC  targeted therapy  
Computational study on novel natural inhibitors targeting BCL2 期刊论文
MEDICAL ONCOLOGY, 2021, 卷号: 38, 期号: 8
Authors:  Lv, Xiaye;  Jiang, Yuting;  Wang, Xinhui;  Xie, HaoQun;  Dou, Gaojing;  Wang, Jing;  Yang, Wenzhuo;  Wang, Hongyu;  Li, Zijian;  Zhang, Xiangheng...Lv, Xiaye;  Jiang, Yuting;  Wang, Xinhui;  Xie, HaoQun;  Dou, Gaojing;  Wang, Jing;  Yang, Wenzhuo;  Wang, Hongyu;  Li, Zijian;  Zhang, Xiangheng;  Chen, Zhenghe
Favorite  |    Submit date:2021/08/12
BCL2  Drug treatment  Inhibitor  Virtual screening  
基于结构的小分子对接软件的评估与应用研究 期刊论文
中国海洋药物, 2018, 卷号: 37, 期号: 4, 页码: 23-30
Authors:  曲晓虹;  纪玮佳;  王卓亚;  陈芳玲;  于日磊;  李伟
Favorite  |    Submit date:2019/10/15
抗肿瘤  分子对接  虚拟筛选  c-Met蛋白  EGFR蛋白  antitumor  molecular docking  virtual screening  c-Met protein  EGFR protein  
Virtual Screening Based on Ensemble Docking Targeting Wild-Type p53 for Anticancer Drug Discovery 期刊论文
CHEMISTRY & BIODIVERSITY, 2019, 卷号: 16, 期号: 7
Authors:  Li, Xin;  Zhang, Xin-Xin;  Lin, Yu-Xi;  Xu, Xi-Ming;  Li, Li;  Yang, Jin-Bo
Favorite  |    Submit date:2019/10/10
virtual screening  p53  torilin  anticancer  cytotoxicity  drug discovery  
Steroids-specific target library for steroids target prediction 期刊论文
STEROIDS, 2018, 卷号: 140, 页码: 83-91
Authors:  Dang, Xiaoxue;  Liu, Zheng;  Zhou, Yanzhuo;  Chen, Peizi;  Liu, Jiyuan;  Yao, Xiaojun;  Lei, Beilei
Favorite  |    Submit date:2019/10/30
Steroids  Target prediction  Structure-based virtual screening  Inverse docking  
A data management system for pre-docking in large-scale virtual screening 会议论文
Proceedings - 5th Annual ChinaGrid Conference, ChinaGrid 2010, Guangzhou, Guangdong, China, July 16, 2010 - July 18, 2010
Authors:  Chen, Jiu Qiang;  Zhang, Rui Sheng;  Chen, Shi Lin;  Li, Li Fen;  Zhang, Ying;  Yuan, Cheng Da;  Li, Lian;  Zhang, R. S. (zhangrs@lzu.edu.cn)
Favorite  |    Submit date:2017/01/18
Database systems  Docking  Drug products plants  Information management  Lead compounds  Parallel architectures  Basic functions  Chemical database  Cost-effective technology  Data management  Data management system  Massive data  Molecular compounds  New approaches  Parallel Computing  Parallel processing  Pharmaceutical industry  Stress test  Virtual Screening  
ChemDataBase 2: An enhanced chemical database management system for virtual screening 会议论文
Proceedings - 5th Annual ChinaGrid Conference, ChinaGrid 2010, Guangzhou, Guangdong, China, July 16, 2010 - July 18, 2010
Authors:  Li, Lifen;  Zhang, Ruisheng;  Chen, Jiuqiang;  Zhang, Ying;  Li, Lian;  Zhao, Zhili;  Zhang, R. (zhangrs@lzu.edu.cn)
Favorite  |    Submit date:2017/01/18
Database systems  Computational chemistry  Data reduction  Management information systems  Basic functions  Chemical data  Chemical database  CSGrid  Data analysis softwares  Data persistence  Drug research  Hibernate  Virtual Screening  
A user-friendly Task Editor Environment for large-scale Virtual Screening application 会议论文
Proceedings - 9th International Conference on Grid and Cloud Computing, GCC 2010, Nanjing, Jiangsu, China, November 1, 2010 - November 5, 2010
Authors:  Ruan, Keyin;  Zhang, Ruisheng;  Ding, Fan;  Li, Lian;  Zhao, Zhili;  Lin, Jiazao;  Zhang, R. (zhangrs@lzu.edu.cn)
Favorite  |    Submit date:2017/01/18
Grid computing  Cloud computing  Computer systems  Data description  Bag-of-Tasks applications  Computational resources  Data dependencies  Grid environments  GRID middleware  Heterogeneous resources  Independent tasks  JSDL  Subtasks  Task decomposition  Task editor  Task executions  Virtual Screening  
A data management tool for virtual screening on grid 会议论文
Proceedings - 2011 6th Annual ChinaGrid Conference, ChinaGrid 2011, Dalian, Liaoning, China, August 22, 2011 - August 23, 2011
Authors:  Zhang, Ying;  Zhang, Ruisheng;  Chen, Jiuqiang;  Yuan, Chengda;  Li, Jingwei;  Zhang, Yan;  Liu, Guangcai;  Zhang, R. (zhangrs@lzu.edu.cn)
Favorite  |    Submit date:2017/01/18
Grid computing  Database systems  Information management  Visualization  Data management tools  Drug development  File formats  Grid node  Heterogeneous database  Integrated frameworks  Intensive computing  Small molecules  Virtual Screening