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Chinese Academy of Sciences Institutional Repositories Grid
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期刊论文 [146]
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Discovery and molecular mechanism of a novel antihypertensive peptide from
Chlamydomonas
reinhardtii
based on molecular docking, molecular dynamics simulation,
in
vitro,
and
in
vivo
analysis
期刊论文
OAI收割
FOOD RESEARCH INTERNATIONAL, 2026, 卷号: 229, 页码: 13
作者:
Suo, Qishan
;
Yue, Yang
;
Wang, Jing
;
Wu, Ning
;
Geng, Lihua
  |  
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  |  
Discovery of novel selective PRMT5-MTA inhibitors through structure-based virtual screening
期刊论文
OAI收割
BIOORGANIC CHEMISTRY, 2026, 卷号: 168, 页码: 17
作者:
Ma, Ning
;
Chen, Yang
;
Liang, Yiru
;
Chen, Xiaoxu
;
Song, Fengnan
  |  
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  |  
AI-enhanced virtual screening approach to hit identification for GluN1/GluN3A NMDA receptor
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 12
作者:
Ji, Yue-shan
;
Zeng, Yue
;
Hu, Shao-fei
;
Li, Shu-wang
;
Zhang, Bei-chen
  |  
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  |  
Identification of small-molecule inhibitors for GluN1/GluN3A NMDA receptors via a multiscale CNN-based prediction model
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 9
作者:
Han, Li
;
Zeng, Yue
;
Qu, Zhi-yan
;
Fang, Sui
;
Wang, Hai-ying
  |  
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  |  
Discovery of selective GluN1/GluN3A NMDA receptor inhibitors using integrated AI and physics-based approaches
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 10
作者:
Li, Shi-wei
;
Zeng, Yue
;
Wu, Sa-nan
;
Ma, Xin-yue
;
Xu, Chao
  |  
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  |  
Contrastive learning-based drug screening model for GluN1/GluN3A inhibitors
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 13
作者:
Li, Kun
;
Zeng, Yue
;
Xiong, Yi-da
;
Wu, Hao-chen
;
Fang, Sui
  |  
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  |  
Discovery of novel GluN1/GluN3A NMDA receptor inhibitors using a deep learning-based method
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 8
作者:
Wang, Shi-hang
;
Zeng, Yue
;
Yang, Hao
;
Tian, Si-yuan
;
Zhou, Yong-qi
  |  
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  |  
An efficient deep learning-based strategy to screen inhibitors for GluN1/GluN3A receptor
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 9
作者:
Wang, Ze-chen
;
Zeng, Yue
;
Sun, Jin-yuan
;
Chen, Xue-qin
;
Wu, Hao-chen
  |  
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  |  
Discovery of novel covalent stabilizers for p53 Y220C using structure-based drug discovery methods
期刊论文
OAI收割
MOLECULAR DIVERSITY, 2025, 页码: 14
作者:
Wen, Yiming
;
Xu, Peijia
;
Chen, Yijie
;
Meng, Jingyi
;
Zheng, Mingyue
  |  
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  |  
Interaction-Based Inductive Bias in Graph Neural Networks: Enhancing Protein-Ligand Binding Affinity Predictions From 3D Structures
期刊论文
OAI收割
IEEE TRANSACTIONS ON PATTERN ANALYSIS AND MACHINE INTELLIGENCE, 2024, 卷号: 46, 期号: 12, 页码: 8191-8208
作者:
Yang, Ziduo
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