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浏览/检索结果: 共294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：7/0  |  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   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：24/0  |  提交时间：2024/06/27 Functional phosphosite  Deep learning  AlphaFold protein structure  Dynamics  Protein protein interaction   A Computational and Chemical Design Strategy for Manipulating Glycan-Protein Recognition 期刊论文  OAI收割 ADVANCED SCIENCE, 2024, 页码: 14 作者:  Zhu, Qiang;  Geng, Didi;  Li, Jingchao;  Zhang, Jinqiu;  Sun, Haofan   |  收藏  |  浏览/下载：20/0  |  提交时间：2024/05/22 CH-pi interaction  glycan-protein recognition  glycoproteomics  PhoSL  core fucose   A new paradigm for applying deep learning to protein-ligand interaction prediction 期刊论文  OAI收割 BRIEFINGS IN BIOINFORMATICS, 2024, 卷号: 25, 期号: 3, 页码: 12 作者:  Wang, Zechen;  Wang, Sheng;  Li, Yangyang;  Guo, Jingjing;  Wei, Yanjie   |  收藏  |  浏览/下载：3/0  |  提交时间：2024/12/06 protein-ligand interaction  scoring function  deep learning  graph neural network   Structural framework for the understanding spectroscopic and functional signatures of the cyanobacterial Orange Carotenoid Protein families 期刊论文  OAI收割 INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 2024, 卷号: 254, 页码: 20 作者:  Sluchanko, Nikolai N.;  Maksimov, Eugene G.;  Slonimskiy, Yury B.;  Varfolomeeva, Larisa A.;  Bukhanko, Antonina Y.   |  收藏  |  浏览/下载：16/0  |  提交时间：2024/01/26 Photoprotection  Phycobilisome fluorescence quenching  Crystal structure  Protein-protein interaction  Absorption spectroscopy  Photoactivity  SEC-MALS   Structural framework for the understanding spectroscopic and functional signatures of the cyanobacterial Orange Carotenoid Protein families 期刊论文  OAI收割 INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 2024, 卷号: 254, 页码: 20 作者:  Sluchanko, Nikolai N.;  Maksimov, Eugene G.;  Slonimskiy, Yury B.;  Varfolomeeva, Larisa A.;  Bukhanko, Antonina Y.   |  收藏  |  浏览/下载：1/0  |  提交时间：2024/11/02 Photoprotection  Phycobilisome fluorescence quenching  Crystal structure  Protein-protein interaction  Absorption spectroscopy  Photoactivity  SEC-MALS   Structural framework for the understanding spectroscopic and functional signatures of the cyanobacterial Orange Carotenoid Protein families 期刊论文  OAI收割 INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 2024, 卷号: 254, 页码: 20 作者:  Sluchanko, Nikolai N.;  Maksimov, Eugene G.;  Slonimskiy, Yury B.;  Varfolomeeva, Larisa A.;  Bukhanko, Antonina Y.   |  收藏  |  浏览/下载：8/0  |  提交时间：2024/11/02 Photoprotection  Phycobilisome fluorescence quenching  Crystal structure  Protein-protein interaction  Absorption spectroscopy  Photoactivity  SEC-MALS   Discovery, Structure-Activity Relationship and In Vitro Anticancer Activity of Small-Molecule Inhibitors of the Protein-Protein Interactions between AF9/ENL and AF4 or DOT1L 期刊论文  OAI收割 CANCERS, 2023, 卷号: 15, 期号: 21, 页码: 28 作者:  Li, Xin;  Wu, Xiaowei;  Nie, Shenyou;  Zhao, Jidong;  Yao, Yuan   |  收藏  |  浏览/下载：24/0  |  提交时间：2023/12/19 MLL-rearranged leukemia  super elongation complexes  small-molecule inhibitor  protein-protein interaction  cancer therapeutics   Discovery of a highly potent NPAS3 heterodimer inhibitor by covalently modifying ARNT 期刊论文  OAI收割 BIOORGANIC CHEMISTRY, 2023, 卷号: 139, 页码: 10 作者:  Li, Peizhuo;  Tian, Yucheng;  Shang, Qinghong;  Tang, Cailing;  Hou, Zeng   |  收藏  |  浏览/下载：32/0  |  提交时间：2023/10/17 NPAS3  Covalent inhibitor  Protein -protein interaction  5-nitrothiazole warhead   Pharmacological characterization of the small molecule 03A10 as an inhibitor of α-synuclein aggregation for Parkinson's disease treatment 期刊论文  OAI收割 ACTA PHARMACOLOGICA SINICA, 2023, 卷号: 44, 期号: 6, 页码: 1122-1134 作者:  Wang, Qing;  Yao, Sheng;  Yang, Ze-xian;  Zhou, Chen;  Zhang, Yu   |  收藏  |  浏览/下载：24/0  |  提交时间：2024/03/27 Parkinson's disease  alpha-synuclein aggregation  protein-protein interaction  03A10  MPTP/p model  enema inoculation model