机构

• 上海药物研究所 [11]
• 广州地球化学研究所 [1]
• 西安光学精密机械研究... [1]

采集方式

• OAI收割 [13]

内容类型

• 期刊论文 [12]
• 专利 [1]

发表日期

• 2026 [1]
• 2025 [3]
• 2024 [4]
• 2023 [1]
• 2022 [3]
• 2007 [1]
• 更多

学科主题

筛选

浏览/检索结果: 共13条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择发表日期升序发表日期降序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 Insights into Protein-Ligand Noncovalent Interaction Networks: A Database Survey and Quantum Chemistry Calculation Study 期刊论文  OAI收割 JOURNAL OF MEDICINAL CHEMISTRY, 2026, 页码: 11 作者:  Luo, Ruitong;  Han, Zijian;  Li, Jintian;  Chen, Yuanjie;  Peng, Ziyu   |  收藏  |  浏览/下载：2/0  |  提交时间：2026/04/01 Hydrogen Bond-Induced Binding between Organofluorine and Protein via Fluorine Atoms: A Database Survey and Quantum Chemistry Calculation Study 期刊论文  OAI收割 JOURNAL OF MEDICINAL CHEMISTRY, 2025, 卷号: 68, 期号: 14, 页码: 14882-14894 作者:  Han, Zijian;  Li, Jintian;  Liao, Qingyi;  Luo, Ruitong;  Wu, Leyun   |  收藏  |  浏览/下载：1/0  |  提交时间：2025/12/04 Enhanced Bioactivity of Natural Products by Halogenation: A Database Survey and Quantum Chemistry Calculation Study 期刊论文  OAI收割 JOURNAL OF MEDICINAL CHEMISTRY, 2025, 卷号: 68, 期号: 10, 页码: 10486-10496 作者:  Cao, Ruini;  Li, Jintian;  Liao, Qingyi;  Shao, Mei;  Zhang, Qian   |  收藏  |  浏览/下载：25/0  |  提交时间：2025/07/25 Dynamically chiral phosphonic acid-type metallo-β-lactamase inhibitors 期刊论文  OAI收割 COMMUNICATIONS CHEMISTRY, 2025, 卷号: 8, 期号: 1, 页码: 13 作者:  Gulyas, Kinga Virag;  Zhou, Liping;  Salamonsen, Daniel;  Prester, Andreas;  Bartels, Kim   |  收藏  |  浏览/下载：36/0  |  提交时间：2025/06/23 Development of ketalized unsaturated saccharides as multifunctional cysteine-targeting covalent warheads 期刊论文  OAI收割 COMMUNICATIONS CHEMISTRY, 2024, 卷号: 7, 期号: 1, 页码: 10 作者:  Dong, Sanfeng;  Huang, Hui;  Li, Jintian;  Li, Xiaomei;  Bunu, Samuel Jacob   |  收藏  |  浏览/下载：57/0  |  提交时间：2024/10/21 Unexpected effect of halogenation on the water solubility of small organic compounds 期刊论文  OAI收割 Computers in biology and medicine, 2024, 卷号: 172, 页码: 108209 作者:  Zhang, Jianfang;  Gulyas, Kinga Virag;  Li, Jintian;  Ma, Minfei;  Zhou, Liping   |  收藏  |  浏览/下载：36/0  |  提交时间：2025/06/04 Impact of Halogen Bonds on Protein-Peptide Binding and Protein Structural Stability Revealed by Computational Approaches 期刊论文  OAI收割 JOURNAL OF MEDICINAL CHEMISTRY, 2024, 页码: 11 作者:  Li, Jintian;  Zhou, Liping;  Han, Zijian;  Wu, Leyun;  Zhang, Jianfang   |  收藏  |  浏览/下载：80/0  |  提交时间：2024/05/07 D3Rings: A Fast and Accurate Method for Ring System Identification and Deep Generation of Drug-Like Cyclic Compounds 期刊论文  OAI收割 JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2024, 卷号: 64, 期号: 3, 页码: 724-736 作者:  Ma, Minfei;  Zhang, Xinben;  Zhou, Liping;  Han, Zijian;  Shi, Yulong   |  收藏  |  浏览/下载：109/0  |  提交时间：2024/03/13 Preferred microenvironments of halogen bonds and hydrogen bonds revealed using statistics and QM/MM calculation studies 期刊论文  OAI收割 PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2023, 卷号: 25, 期号: 26, 页码: 17692-17699 作者:  Zhou, Liping;  Li, Jintian;  Shi, Yulong;  Wu, Leyun;  Zhu, Weiliang   |  收藏  |  浏览/下载：91/0  |  提交时间：2023/10/17 D3AI-Spike: A deep learning platform for predicting binding affinity between SARS-CoV-2 spike receptor binding domain with multiple amino acid mutations and human angiotensin-converting enzyme 2 期刊论文  OAI收割 COMPUTERS IN BIOLOGY AND MEDICINE, 2022, 卷号: 151, 页码: 8 作者:  Han, Jiaxin;  Liu, Tingting;  Zhang, Xinben;  Yang, Yanqing;  Shi, Yulong   |  收藏  |  浏览/下载：62/0  |  提交时间：2023/04/10 D3AI-Spike  ELISA  Protein -protein interaction  COVID-19  Deep learning