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金属研究所 [41]
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Interface exploring in fiber-reinforced composite coatings: Enhancing corrosion resistance, mechanical stability, and real-time monitoring
期刊论文
OAI收割
PROGRESS IN ORGANIC COATINGS, 2026, 卷号: 212, 页码: 17
作者:
Yuan, Shuai
;
Zhao, Xia
;
Jin, Zuquan
;
Wang, Pan
;
Guo, Haoran
  |  
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  |  
From Multi-Species Screening to Targeted Investigation: Discovery of ACE Inhibitory Peptides in
Gigantidas platifrons
via Peptidomics, Virtual Screening, and Molecular Dynamics Simulations
期刊论文
OAI收割
MOLECULES, 2026, 卷号: 31, 期号: 5, 页码: 18
作者:
Zhang, Haorui
;
Ouyang, Yuhong
;
Suo, Qishan
;
Chen, Hao
;
Cui, Jie
  |  
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  |  
Optimizing computational prediction of shrimp-WSSV protein interactions through integration of homology- and topology-based predictions
期刊论文
OAI收割
MOLECULAR GENETICS AND GENOMICS, 2026, 卷号: 301, 期号: 1, 页码: 10
作者:
Yang, Zhanyuan
;
Yuan, Jianbo
;
Li, Shihao
;
Zhang, Xiaojun
;
Li, Fuhua
  |  
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  |  
Structure-based design of novel THR-β agonists and mechanism of activation research by molecular dynamics simulations
期刊论文
OAI收割
BIOORGANIC & MEDICINAL CHEMISTRY, 2025, 卷号: 131, 页码: 15
作者:
Gao, Yang
;
Zhu, Haoran
;
Gao, Li-Xin
;
Xu, Gao-Ya
;
Lin, Jing
  |  
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  |  
3CL
pro
of SARS-CoV-2 as a new target for bufadienolides: in silico and in vitro study
期刊论文
OAI收割
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN, 2025, 卷号: 39, 期号: 1, 页码: 15
作者:
Kayumov, Muzaffar
;
Razzokov, Jamoliddin
;
Makhkamov, Mukhriddin
;
Radjabov, Murodjon
;
Mukhamedov, Nurkhodja
  |  
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  |  
Fine structural design of 3βHSD1 inhibitors for prostate cancer
期刊论文
OAI收割
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2025, 卷号: 122, 期号: 26, 页码: 12
作者:
He, Dongyin
;
Zhang, Luyao
;
Yu, Leiye
;
Zhang, Yuhang
;
Chen, Jingjing
  |  
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  |  
Network Pharmacology and Molecular Dynamics Simulations Reveal the Mechanism of Total Alkaloid Components in Anisodus Tanguticus (Maxim.) Pascher in Treating Inflammation and Pain
期刊论文
OAI收割
CHEMISTRY & BIODIVERSITY, 2025, 卷号: 22, 期号: 1
作者:
Tan, Nixia
;
Wang, Yue
;
Ren, Lichengcheng
;
Tie, Fangfang
;
Hu, Na
  |  
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  |  
Molecular dynamics simulations of the shear and tensile mechanical properties of rare-earth metal erbium based on deep-learning potential
期刊论文
OAI收割
MATERIALS TODAY COMMUNICATIONS, 2024, 卷号: 41, 页码: 11
作者:
Xue, Hong-Tao
;
Chang, Zhen
;
Li, Juan
;
Yang, Yan-Hong
;
Ren, Jun-Qiang
  |  
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  |  
Coupling structural, chemical composition and stress fluctuations with relaxation dynamics in metallic glasses
期刊论文
OAI收割
ACTA MATERIALIA, 2024, 卷号: 275, 页码: 7
作者:
Sopu, D.
;
Yuan, X.
;
Spieckermann, F.
;
Eckert, J.
  |  
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  |  
Recognizing the function of different silane coupling agents on MXene adsorption/barrier behavior in solvent-borne epoxy coatings: Experimental studies, density functional theory, and molecular dynamics simulations
期刊论文
OAI收割
PROGRESS IN ORGANIC COATINGS, 2024, 卷号: 192, 页码: 15
作者:
Pourhashem, Sepideh
;
Hadizadeh, Mohammad Hassan
;
Ji, Xiaohong
;
Zhou, Ziyang
;
Duan, Jizhou
  |  
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