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ShanghaiTech University Knowledge Management System
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Lung-Specific mRNA Delivery by Ionizable Lipids with Defined Structure-Function Relationship and Unique Protein Corona Feature
期刊论文
ADVANCED SCIENCE, 2025
作者:
He, Xiaoyan
;
Wang, Runyuan
;
Cao, Yan
;
Ding, Yan
;
Chang, Yan
Adobe PDF(14333Kb)
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收藏
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浏览/下载:64/7
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提交时间:2025/03/03
lipid nanoparticle
lung-targeted
mRNA delivery
protein corona
structure-function relationship
Prediction of Solvate Based on Graph Attention Network
期刊论文
CRYSTAL GROWTH & DESIGN, 2025, 卷号: 25, 期号: 2
作者:
Sun, Shihui
;
Wang, Jian-Rong
;
Tang, Lei
;
Fan, Zhehuan
;
Li, Xutong
Adobe PDF(4799Kb)
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收藏
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浏览/下载:58/1
|
提交时间:2025/01/13
Physicochemical properties
Active pharmaceuticals ingredients
Attention mechanisms
Crystal properties
Crystallization process
Drug quality
Graph neural networks
Model-based OPC
Neural network model
Pharmaceutical development
Residual solvents
Targeted Degradation of SOS1 Exhibits Potent Anticancer Activity and Overcomes Resistance in KRAS-Mutant Tumors and BCR-ABL-Positive Leukemia
期刊论文
CANCER RESEARCH, 2025, 卷号: 85, 期号: 1
作者:
Luo, Ziwei
;
Lin, Chencen
;
Yu, Chuwei
;
Yuan, Changxian
;
Wu, Wenyong
Adobe PDF(22554Kb)
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浏览/下载:166/4
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提交时间:2025/01/13
Targeted Delivery of mRNA with Polymer-Lipid Nanoparticles for In Vivo Base Editing
期刊论文
ACS NANO, 2025, 卷号: 19, 期号: 8
作者:
Chen, Qimingxing
;
Chang, Yan
;
He, Xiaoyan
;
Ding, Yan
;
Wang, Runyuan
Adobe PDF(12364Kb)
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收藏
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浏览/下载:117/21
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提交时间:2025/02/28
Biological organs
Elastomers
Gene encoding
Lipoproteins
RNA
Amino esters
Base editing
Hydrophobics
Hyperlipidemia
In-vivo
Lipid nanoparticles
Messenger RNA
RNA encoding
Synthesised
Targeted delivery
Prediction of Multi-Pharmacokinetics Property in Multi-Species: Bayesian Neural Network Stacking Model with Uncertainty
期刊论文
MOLECULAR PHARMACEUTICS, 2024, 卷号: 21, 期号: 12
作者:
Zhang, Yuanyuan
;
Xie, Zhiyin
;
Xiao, Fu
;
Yu, Jie
;
Fan, Zhehuan
Adobe PDF(5565Kb)
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收藏
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浏览/下载:152/1
|
提交时间:2024/11/19
pharmacokinetic parameters
machine learning
uncertainty
stacking
multitask learning
ADME
Rapid Self-Assembly Mini-Livers Protect Mice Against Severe Hepatectomy-Induced Liver Failure
期刊论文
ADVANCED SCIENCE, 2024, 卷号: 11, 期号: 21
作者:
Miaomiao Luo, Jiahui Lai, Enhua Zhang, Yue Ma, Runbang He, Lina Mao, Bo Deng, Junjin Zhu, Yan Ding, Jialyu Huang, Bin Xue, Qiangsong Wang, Mingming Zhang, Pengyu Huang
Adobe PDF(8411Kb)
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收藏
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浏览/下载:294/0
|
提交时间:2024/04/02
Artificial organs
Self assembly
Stem cells
Acute liver injury
Bioartificial liver
Disease models
Drug development
Hepatocytes
Liver failure
Model drugs
Organoids
Rapid self assembly
Regenerative medicine
Reducing overconfident errors in molecular property classification using Posterior Network
期刊论文
PATTERNS, 2024, 卷号: 5, 期号: 6
作者:
Fan, Zhehuan
;
Yu, Jie
;
Zhang, Xiang
;
Chen, Yijie
;
Sun, Shihui
Adobe PDF(2007Kb)
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收藏
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浏览/下载:146/0
|
提交时间:2024/06/07
Computational chemistry
Deep learning
Drug products
Artificial intelligence-aided drug design
Classification models
Drug Design
Drug development
Molecular properties
Property classification
QSAR
Trustworthy AI
Uncertainty estimation
Uncertainty quantifications
KinomeMETA: meta-learning enhanced kinome-wide polypharmacology profiling
期刊论文
BRIEFINGS IN BIOINFORMATICS, 2023
作者:
Qun Ren
;
Ning Qu
;
Jingjing Sun
;
Jingyi Zhou
;
Jin Liu
Adobe PDF(2916Kb)
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收藏
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浏览/下载:146/9
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提交时间:2024/11/27
deep learning
kinase inhibitors
kinome profiling
meta-learning
polypharmacology
Computing the relative binding affinity of ligands based on a pairwise binding comparison network
期刊论文
NATURE COMPUTATIONAL SCIENCE, 2023, 卷号: 3, 期号: 10, 页码: 860-872
作者:
Yu, Jie
;
Li, Zhaojun
;
Chen, Geng
;
Kong, Xiangtai
;
Hu, Jie
Adobe PDF(3742Kb)
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收藏
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浏览/下载:454/124
|
提交时间:2023/11/10
Binding energy
Computational efficiency
Structural optimization
Web services
Attention mechanisms
Comparison networks
Drug discovery
Fine tuning
Lead optimization
Network-based
Prediction accuracy
Relative binding affinity
Structure-based
Tuning operation
Learning protein fitness landscapes with deep mutational scanning data from multiple sources
期刊论文
CELL SYSTEMS, 2023, 卷号: 14, 期号: 8
作者:
Chen, Lin
;
Zhang, Zehong
;
Li, Zhenghao
;
Li, Rui
;
Huo, Ruifeng
Adobe PDF(6402Kb)
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收藏
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浏览/下载:122/0
|
提交时间:2023/09/18
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