中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海药物研究所 [7]
海洋研究所 [1]
采集方式
OAI收割 [8]
内容类型
期刊论文 [8]
发表日期
2026 [2]
2025 [3]
2024 [2]
2022 [1]
学科主题
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浏览/检索结果:
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Skin-penetrating peptides derived from computational simulation improve transdermal absorption and facilitate topical treatment of melanoma
期刊论文
OAI收割
ACTA PHARMACEUTICA SINICA B, 2026, 卷号: 16, 期号: 2, 页码: 1140-1154
作者:
Du, Sanjiang
;
Wang, Hanlin
;
Geng, Feiyang
;
Zhang, Zongxu
;
Liu, Chenghao
  |  
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2026/04/01
Cell-penetrating peptides
Cutaneous administration
Computational simulation
Melanoma
Floxuridine
AlphaFold
Transdermal drug delivery
Penetratin
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
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2026/06/02
Protein-protein interactions
Penaeid shrimp
STRING interaction
AlphaFold3 modeling
Molecular dynamics simulations
An update for AlphaFold3 versus experimental structures: assessing the precision of small molecule binding in GPCRs
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 10
作者:
Shen, Shi-yi
;
Li, Jun-rui
;
Wang, Yu-song
  |  
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2025/09/09
GPCR
AlphaFold3
experimental structures
global receptor architecture
orthosteric binding pockets
allosteric modulator
structure-based drug design
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
  |  
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2025/09/09
prostate cancer
drug development
AlphaFold
molecular simulations
3 beta 3HSD1
Strategic Amino Acid Mutations in CPD Cleavage Motif: Impacts on Hydrolysis and C-Terminal Modification Efficiency
期刊论文
OAI收割
CHEMICAL RESEARCH IN CHINESE UNIVERSITIES, 2025, 卷号: 41, 期号: 3, 页码: 592-600
作者:
Yashinov, Ansor
;
Zou, Xiangman
;
Hang, Jiayin
;
Liu, Zhi
;
Song, Fengnan
  |  
收藏
  |  
浏览/下载:38/0
  |  
提交时间:2025/06/23
Protein engineering
C-Terminal modification
Cysteine protease domain
Self-cleavage tag
AlphaFold2
AlphaFold3 versus experimental structures: assessment of the accuracy in ligand-bound G protein-coupled receptors
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2024, 页码: 12
作者:
He, Xin-heng
;
Li, Jun-rui
;
Shen, Shi-yi
;
Xu, H. Eric
  |  
收藏
  |  
浏览/下载:52/0
  |  
提交时间:2025/01/14
AlphaFold
structure-based drug design
artificial intelligence
GPCR
structural biology
FuncPhos-STR: An integrated deep neural network for functional phosphosite prediction based on AlphaFold protein structure and dynamics
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 2024, 卷号: 266, 页码: 11
作者:
Zhang, Guangyu
;
Zhang, Cai
;
Cai, Mingyue
;
Luo, Cheng
;
Zhu, Fei
  |  
收藏
  |  
浏览/下载:88/0
  |  
提交时间:2024/06/27
Functional phosphosite
Deep learning
AlphaFold protein structure
Dynamics
Protein protein interaction
AlphaFold2 versus experimental structures: evaluation on G protein-coupled receptors
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2022, 页码: 7
作者:
He, Xin-heng
;
You, Chong-zhao
;
Jiang, Hua-liang
;
Jiang, Yi
;
Xu, H. Eric
  |  
收藏
  |  
浏览/下载:61/0
  |  
提交时间:2022/08/16
G protein-coupled receptors
AlphaFold2
protein structure prediction
drug design
structural biology