机构

• 上海药物研究所 [12]
• 大连化学物理研究所 [3]
• 计算技术研究所 [2]
• 新疆理化技术研究所 [2]
• 化学研究所 [1]
• 武汉物理与数学研究所 [1]
• 更多

采集方式

• OAI收割 [23]
• iSwitch采集 [2]

内容类型

• 期刊论文 [25]

发表日期

• 2023 [2]
• 2022 [1]
• 2021 [2]
• 2020 [2]
• 2019 [5]
• 2018 [4]
• 更多

学科主题

• Engineerin... [1]
• Research &... [1]

筛选

浏览/检索结果: 共25条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序发表日期升序发表日期降序题名升序题名降序作者升序作者降序 MolFilterGAN: a progressively augmented generative adversarial network for triaging AI-designed molecules 期刊论文  OAI收割 JOURNAL OF CHEMINFORMATICS, 2023, 卷号: 15, 期号: 1, 页码: 42 作者:  Liu, Xiaohong;  Zhang, Wei;  Tong, Xiaochu;  Zhong, Feisheng;  Li, Zhaojun   |  收藏  |  浏览/下载：4/0  |  提交时间：2024/03/27 De novo molecule design  Generative models  Deep learning  Virtual screening  Compound quality control   Discovery of Novel Drug-like PHGDH Inhibitors to Disrupt Serine Biosynthesis for Cancer Therapy 期刊论文  OAI收割 JOURNAL OF MEDICINAL CHEMISTRY, 2023, 页码: 21 作者:  Gao, Dingding;  Tang, Shuai;  Cen, Yixin;  Yuan, Liang;  Lan, Xiaojing   |  收藏  |  浏览/下载：19/0  |  提交时间：2023/04/10 Validation of Deep Learning-Based DFCNN in Extremely Large-Scale Virtual Screening and Application in Trypsin I Protease Inhibitor Discovery 期刊论文  OAI收割 FRONTIERS IN MOLECULAR BIOSCIENCES, 2022, 卷号: 9, 页码: 15 作者:  Zhang, Haiping;  Lin, Xiao;  Wei, Yanjie;  Zhang, Huiling;  Liao, Linbu   |  收藏  |  浏览/下载：16/0  |  提交时间：2022/12/07 extremely large-scale virtual screening  deep learning  DFCNN  Trypsin I Protease  de novo drug screening   Oridonin inhibits DNMT3A R882 mutation-driven clonal hematopoiesis and leukemia by inducing apoptosis and necroptosis 期刊论文  OAI收割 CELL DEATH DISCOVERY, 2021, 卷号: 7, 期号: 1, 页码: 12 作者:  Liao, Min;  Dong, Qiongye   |  收藏  |  浏览/下载：50/0  |  提交时间：2021/12/01 Discovery of Novel Allosteric Modulators Targeting an Extra-Helical Binding Site of GLP-1R Using Structure- and Ligand-Based Virtual Screening 期刊论文  OAI收割 BIOMOLECULES, 2021, 卷号: 11, 期号: 7, 页码: 14 作者:  Zhou, Qingtong;  Guo, Wanjing;  Dai, Antao;  Cai, Xiaoqing;  Vass, Marton   |  收藏  |  浏览/下载：31/0  |  提交时间：2021/08/17 GLP-1R  virtual screening  allosteric modulator  drug discovery  molecular docking   An in vitro Fo''rster resonance energy transfer-based high-throughput screening assay identifies inhibitors of SUMOylation E2 Ubc9 期刊论文  OAI收割 ACTA PHARMACOLOGICA SINICA, 2020, 页码: 10 作者:  Wang, Yu-zhe;  Liu, Xiao;  Way, George;  Madarha, Vipul;  Zhou, Qing-tong   |  收藏  |  浏览/下载：25/0  |  提交时间：2020/07/01 SUMOylation inhibitor  WNN0605-F008  high-throughput screening  Ubc9  PIAS1  Fo''rster resonance energy transfer  surface plasmon resonance   High-throughput screening campaign identifies a small molecule agonist of the relaxin family peptide receptor 4 期刊论文  OAI收割 ACTA PHARMACOLOGICA SINICA, 2020, 页码: 9 作者:  Lin, Guang-yao;  Lin, Lin;  Cai, Xiao-qing;  Dai, An-tao;  Zhu, Yue   |  收藏  |  浏览/下载：22/0  |  提交时间：2020/07/01 RXFP4  INSL5  high-throughput screening  agonist  JK1   Extensive characterization and differential analysis of endogenous peptides from Bombyx batryticatus using mass spectrometric approach 期刊论文  OAI收割 JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS, 2019, 卷号: 163, 页码: 78-87 作者:  Bai, Yunpeng;  Zhao, Qiang;  He, Meixi;  Ye, Xueting;  Zhang, Xiaozhe   |  收藏  |  浏览/下载：40/0  |  提交时间：2019/06/20 Peptidomics  Bombyx batryticatus  Cysteine tagging  Differential analysis   Extensive characterization and differential analysis of endogenous peptides from bombyx batryticatus using mass spectrometric approach 期刊论文  iSwitch采集 Journal of pharmaceutical and biomedical analysis, 2019, 卷号: 163, 页码: 78-87 作者:  Bai, Yunpeng;  Zhao, Qiang;  He, Meixi;  Ye, Xueting;  Zhang, Xiaozhe 收藏  |  浏览/下载：67/0  |  提交时间：2019/05/08 Peptidomics  Bombyx batryticatus  Cysteine tagging  Differential analysis   Pharmacophore-based drug design for the identification of novel butyrylcholinesterase inhibitors against Alzheimer's disease 期刊论文  OAI收割 PHYTOMEDICINE, 2019, 卷号: 54, 期号: 2, 页码: 278-290 作者:  Jiang, YY (Jiang, Yingying)[ 2 ];  Gao, HW (Gao, Hongwei)[ 1,2 ]   |  收藏  |  浏览/下载：46/0  |  提交时间：2019/03/19 Alzheimer's disease (AD)  Butyrylcholinesterase (BChE)  Flavonoids  Pharmacophore models  Molecular docking  De novo evolution