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Primerdiffer: a python command-line module for large-scale primer design in haplotype genotyping
期刊论文
BIOINFORMATICS, 2023, 卷号: 39, 期号: 4, 页码: 2
作者:
Ren, Xiaoliang
;
Shao, Yanwen
;
Zhang, Yiwen
;
Ni, Ying
;
Bi, Yu
收藏
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浏览/下载:0/0
  |  
提交时间:2023/12/13
Self-assembly of an in silico designed dipeptide derivative to obtain photo-responsive vesicles
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24, 期号: 45, 页码: 27751-27758
作者:
Zhang, Jun
;
Wang, Yining
;
Wang, Junfeng
;
Yan, Youguo
;
Li, Jiawei
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  |  
浏览/下载:17/0
  |  
提交时间:2023/01/04
Discovery of potential small molecular SARS-CoV-2 entry blockers targeting the spike protein
期刊论文
ACTA PHARMACOLOGICA SINICA, 2021, 页码: 9
作者:
Wang, Lin
;
Wu, Yan
;
Yao, Sheng
;
Ge, Huan
;
Zhu, Ya
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  |  
浏览/下载:86/0
  |  
提交时间:2021/11/04
SARS-CoV-2
natural products
virtual screening
spike protein
protein-protein interaction modulators
Prediction of the Liquid-Liquid Extraction Properties of Imidazolium-Based Ionic Liquids for the Extraction of Aromatics from Aliphatics
期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2021, 卷号: 61, 期号: 7, 页码: 3376-3385
作者:
Yu, Tianhao
;
Olsson, Emilia
;
Lian, Guoping
;
Liu, Lei
;
Huo, Feng
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  |  
浏览/下载:26/0
  |  
提交时间:2021/08/31
Design, synthesis, and biological evaluation of tetrahydroquinolin derivatives as potent inhibitors of CBP bromodomain
期刊论文
BIOORGANIC CHEMISTRY, 2020, 卷号: 101, 页码: 11
作者:
Chen, Yu
;
Bi, Xiaoyang
;
Zhang, Fengcai
;
Sun, Zhongya
;
Xu, Pan
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  |  
浏览/下载:24/0
  |  
提交时间:2020/12/24
In silico screening
Drug design
CBP
Bromodomain
Inhibitor
Acute Myeloblastic Leukemia
In Silico Screening-Based Discovery of Novel Inhibitors of Human Cyclic GMP-AMP Synthase: A Cross-Validation Study of Molecular Docking and Experimental Testing
期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2020, 卷号: 60, 期号: 6, 页码: 3265-3276
作者:
Zhao, Wenfeng
;
Xiong, Muya
;
Yuan, Xiaojing
;
Li, Minjun
;
Sun, Hongbin
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  |  
浏览/下载:17/0
  |  
提交时间:2020/12/24
Effective Virtual Screening Strategy toward heme-containing proteins: Identification of novel IDO1 inhibitors
期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2019, 卷号: 184, 页码: 23
作者:
Zou, Yi
;
Hu, Yue
;
Ge, Shushan
;
Zheng, Yingbo
;
Li, Yuezhen
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  |  
浏览/下载:34/0
  |  
提交时间:2020/07/01
IDO1
Heme
T cell
Cancer immunotherapy
Virtual screening
Drug design
Molecular dynamics simulation
In silico study of molecular mechanisms of action: Estrogenic disruptors among phthalate esters
期刊论文
ENVIRONMENTAL POLLUTION, 2019, 卷号: 255, 页码: -
作者:
Zhu, Qian
;
Liu, Lanhua
;
Zhou, Xiaohong
;
Ma, Mei
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  |  
浏览/下载:18/0
  |  
提交时间:2020/10/23
In silica
Phthalate esters
Human estrogen receptor alpha
DeepCPI: A Deep Learning-based Framework for Large-scale in silico Drug Screening
期刊论文
GENOMICS PROTEOMICS & BIOINFORMATICS, 2019, 卷号: 17, 期号: 5, 页码: 478-495
作者:
Wan, Fangping
;
Zhu, Yue
;
Hu, Hailin
;
Dai, Antao
;
Cai, Xiaoqing
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  |  
浏览/下载:27/0
  |  
提交时间:2020/07/01
Deep learning
Machine learning
Drug discovery
In silico drug screening
Compound-protein interaction prediction
Solution NMR structure of CGL2373, a polyketide cyclase-like protein from Corynebacterium glutamicum
期刊论文
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2019, 页码: 5
作者:
Cai, Cong
;
Nie, Yao
;
Gong, Yixuan
;
Li, Shuangli
;
Ramelot, Theresa A.
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  |  
浏览/下载:71/0
  |  
提交时间:2019/10/14
aromatic ring
Bet v1
Polyketide_cyc2
PYR1-like
START-like
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