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Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海药物研究所 [25]
烟台海岸带研究所 [3]
宁波材料技术与工程研... [2]
昆明植物研究所 [2]
计算技术研究所 [1]
采集方式
OAI收割 [33]
内容类型
期刊论文 [33]
发表日期
2025 [5]
2024 [1]
2023 [2]
2022 [4]
2021 [4]
2020 [5]
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浏览/检索结果:
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GlycanInsight: an open platform for carbohydrate-binding pocket prediction and characterization
期刊论文
OAI收割
CHEMICAL SCIENCE, 2025, 卷号: 16, 期号: 23, 页码: 10
作者:
Chu, Qinyu
;
He, Xinheng
;
Tan, Xinyi
;
Gu, Zhiyong
;
Luo, Yin
  |  
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2025/07/25
In vivo tracking of leaf-delivered titanium dioxide nanopesticide in ginseng plant using surface-enhanced Raman scattering-labeled techniques
期刊论文
OAI收割
MICROCHEMICAL JOURNAL, 2025, 卷号: 212, 页码: 8
作者:
Sun, Wen
;
Yuan, Qi
;
Tan, Mingyue
  |  
收藏
  |  
浏览/下载:30/0
  |  
提交时间:2025/06/09
Nano-pesticide
Surface-enhanced Raman scattering
In vivo tracking
Ginseng plant
1381
Residue-Selective Inhibitors Discovery via Covalent DNA-Encoded Chemical Libraries with Diverse Warheads
期刊论文
OAI收割
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2025, 卷号: 147, 期号: 18, 页码: 15469-15481
作者:
Wu, Xinyuan
;
Pan, Jiayi
;
Fan, Rufeng
;
Zhang, Yiwei
;
Wang, Chao
  |  
收藏
  |  
浏览/下载:40/0
  |  
提交时间:2025/06/23
Proteome-Wide Data Guides the Discovery of Lysine-Targeting Covalent Inhibitors Using DNA-Encoded Chemical Libraries
期刊论文
OAI收割
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2025, 页码: 14
作者:
Wu, Xinyuan
;
Li, Shunyao
;
Liang, Ting
;
Yu, Qing
;
Zhang, Yiwei
  |  
收藏
  |  
浏览/下载:46/0
  |  
提交时间:2025/06/23
Activity-based protein profiling data
Covalent DNA-encoded chemical library
Covalent ligand selection
Lysine-targeting covalent inhibitors
Targeting the histone reader ZMYND8 inhibits antiandrogen-induced neuroendocrine tumor transdifferentiation of prostate cancer
期刊论文
OAI收割
NATURE CANCER, 2025, 页码: 37
作者:
Wang, Hanling
;
Zhang, Sulin
;
Pan, Qiang
;
Guo, Jiacheng
;
Li, Ni
  |  
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2025/05/27
Inflammatory bowel disease alters in vivo distribution of orally administrated nanoparticles: Revealing via SERS tag labeling technique
期刊论文
OAI收割
TALANTA, 2024, 卷号: 275, 页码: 9
作者:
Tan, Mingyue
;
Wang, Yunqing
  |  
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2024/10/24
Surface-enhanced Raman scattering
SERS tag
Inflammatory bowel disease
Nanoparticles
In vivo
MolFilterGAN: a progressively augmented generative adversarial network for triaging AI-designed molecules
期刊论文
OAI收割
JOURNAL OF CHEMINFORMATICS, 2023, 卷号: 15, 期号: 1, 页码: 42
作者:
Liu, Xiaohong
;
Zhang, Wei
;
Tong, Xiaochu
;
Zhong, Feisheng
;
Li, Zhaojun
  |  
收藏
  |  
浏览/下载:54/0
  |  
提交时间:2024/03/27
De novo molecule design
Generative models
Deep learning
Virtual screening
Compound quality control
High-throughput screening of SARS-CoV-2 main and papain-like protease inhibitors
期刊论文
OAI收割
PROTEIN & CELL, 2023, 卷号: 14, 期号: 1, 页码: 17-27
作者:
Zang, Yi
;
Su, Mingbo
;
Wang, Qingxing
;
Cheng, Xi
;
Zhang, Wenru
  |  
收藏
  |  
浏览/下载:59/0
  |  
提交时间:2024/03/27
high-throughput screening
SARS
CoV-2
main
papain-like
proteases
Blood–brain barrier penetration prediction enhanced by uncertainty estimation
期刊论文
OAI收割
Journal of Cheminformatics, 2022, 卷号: 14, 期号: 1
作者:
Tong,Xiaochu
;
Wang,Dingyan
;
Ding,Xiaoyu
;
Tan,Xiaoqin
;
Ren,Qun
  |  
收藏
  |  
浏览/下载:74/0
  |  
提交时间:2022/08/16
Blood–brain barrier penetration
BBBp prediction
Uncertainty estimation
An inductive graph neural network model for compound-protein interaction prediction based on a homogeneous graph
期刊论文
OAI收割
BRIEFINGS IN BIOINFORMATICS, 2022, 页码: 13
作者:
Wan, Xiaozhe
;
Wu, Xiaolong
;
Wang, Dingyan
;
Tan, Xiaoqin
;
Liu, Xiaohong
  |  
收藏
  |  
浏览/下载:74/0
  |  
提交时间:2022/06/15
compound-protein interaction prediction
homogeneous graph
end-to-end learning
inductive graph neural network