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浏览/检索结果: 共155条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 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;  Zhong, Weihe;  Lv, Qiujie;  Dong, Tiejun;  Chen, Guanxing   |  收藏  |  浏览/下载：12/0  |  提交时间：2025/01/14 Proteins  Programmable logic arrays  Three-dimensional displays  Predictive models  Graph neural networks  Data models  Convolution  Protein-ligand binding affinity  graph neural networks  inductive bias  drug-target interaction  structure-based virtual screening   Synchrotron Radiation: A Key Tool for Drug Discovery 期刊论文  OAI收割 BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2024, 卷号: 114, 页码: 10 作者:  Li, Fengcheng;  Liu, Runze;  Li, Wenjun;  Xie, Mingyuan;  Qin, Song   |  收藏  |  浏览/下载：7/0  |  提交时间：2024/12/06 Synchrotron radiation  Drug discovery  Protein crystals  Structure determination  Ligand screening   Synchrotron Radiation: A Key Tool for Drug Discovery 期刊论文  OAI收割 BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2024, 卷号: 114, 页码: 10 作者:  Li, Fengcheng;  Liu, Runze;  Li, Wenjun;  Xie, Mingyuan;  Qin, Song   |  收藏  |  浏览/下载：9/0  |  提交时间：2024/12/06 Synchrotron radiation  Drug discovery  Protein crystals  Structure determination  Ligand screening   Conformation Influences Biological Fates of Peptide-Based Nanofilaments by Modulating Protein Adsorption and Interfilament Entanglement 期刊论文  OAI收割 ADVANCED MATERIALS, 2024, 页码: 15 作者:  Cai, Ying;  Xu, Tiantian;  Zhu, Binyu;  Chen, Junfan;  Jiang, Linyang   |  收藏  |  浏览/下载：10/0  |  提交时间：2025/01/14 drug delivery  nanofilaments  peptides  protein adsorptions  self-assembly   The application of nanodiscs in membrane protein drug discovery & development and drug delivery 期刊论文  OAI收割 FRONTIERS IN CHEMISTRY, 2024, 卷号: 12 作者:  Dong, Yingkui;  Tang, Huan;  Dai, Han;  Zhao, Hongxin;  Wang, Junfeng   |  收藏  |  浏览/下载：6/0  |  提交时间：2024/11/20 nanodisc (ND)  membrane protein  drug discovery & development  drug delievery  membrane scaffold protein (MSP)   Substrate and Functional Diversity of Protein Lysine Post-translational Modifications 期刊论文  OAI收割 GENOMICS PROTEOMICS & BIOINFORMATICS, 2024, 卷号: 22, 期号: 1, 页码: 21 作者:  Hao, Bingbing;  Chen, Kaifeng;  Zhai, Linhui;  Liu, Muyin;  Liu, Bin   |  收藏  |  浏览/下载：5/0  |  提交时间：2024/12/16 Protein lysine PTM  Regulatory enzyme  PTM crosstalk  Drug target  Acylation   Risk of drug-drug interactions in China's fight against COVID-19 and beyond 期刊论文  OAI收割 PHARMACOLOGICAL RESEARCH, 2023, 卷号: 196, 页码: 2 作者:  Zhang, Qingpeng;  Yang, Jiannan;  Zeng, Daniel Dajun;  Feng, Yibin;  Wong, Ian C. K.   |  收藏  |  浏览/下载：29/0  |  提交时间：2024/03/26 Drug interactions  Protein-protein interactions  Network science  COVID-19   Deffini: A family-specific deep neural network model for structure-based virtual screening 期刊论文  OAI收割 COMPUTERS IN BIOLOGY AND MEDICINE, 2022, 卷号: 151, 页码: 8 作者:  Zhou, Dixin;  Liu, Fei;  Zheng, Yiwen;  Hu, Liangjian;  Huang, Tao   |  收藏  |  浏览/下载：20/0  |  提交时间：2023/04/10 Virtual screening  Protein family -specific model  Structure -based  Convolutional neural network  Drug discovery   Proteomic characterization of post-translational modifications in drug discovery 期刊论文  OAI收割 ACTA PHARMACOLOGICA SINICA, 2022, 页码: 18 作者:  Zhai, Lin-hui;  Chen, Kai-feng;  Hao, Bing-bing;  Tan, Min-jia   |  收藏  |  浏览/下载：25/0  |  提交时间：2023/04/10 proteomics  protein post-translational modification  drug target  off-target  drug mechanism  precision medicine   DeepBindBC: A practical deep learning method for identifying native-like protein-ligand complexes in virtual screening 期刊论文  OAI收割 METHODS, 2022, 卷号: 205, 页码: 247-262 作者:  Zhang, Haiping;  Zhang, Tingting;  Saravanan, Konda Mani   |  收藏  |  浏览/下载：17/0  |  提交时间：2023/07/12 Native like protein-ligand  Drug virtual screening  ResNet  Deep learning  Human pancreatic alpha amylase inhibitor