-
利用超大规模分子动力学模拟技术,开展:
生物膜系统与药物智能化设计
蛋白质结构-功能机制
- . Engineering the substrate preference of glucose oxidase for the enzymatic oxidation of xylose. GREEN CHEMISTRY, 26, 4851, 2024.
- 刘卓. Enhanced Sampling Molecular Dynamics Simulations Reveal Transport Mechanism of Glycoconjugate Drugs through GLUT1. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES , 2024.
- 蒋绪恺. Structure-Interaction Relationship of Polymyxins with Lung Surfactant. Journal of Medicianal Chemistry, 66, 16109-16119, 2024.
- 窦智欣. Data-driven strategies for the computational design of enzyme thermal stability: trends, perspectives, and prospects. Acta Biochimica et Biophysica Sinica, 55, 343-355, 2024.
- 赵沙. Engineering the Relatively Conserved Residues in Active Site Architecture of Thermophilic Chitinase SsChi18A Enhanced Catalytic Activity. Biomacromolecules, 25, 2024.
- 宋宇轩. Comparative molecular dynamics simulations identify a salt-sensitive loop responsible for the halotolerant activity of GH5 cellulases. JOURNAL OF BIOMOLECULAR STRUCTURE AND DYNAMICS, 2023.
- 蒋绪恺. Molecular dynamics simulations informed by membrane lipidomics reveal the structure-interaction relationship of polymyxins with the lipid A-based outer membrane of Acinetobacter baumannii. Journal of Antimicrobial Chemotherapy, 3534, 2023.
- 曹雪婷. Molecular Dynamics Simulations Reveal the Conformational Transition of GH33 Sialidases. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 24, 2023.
- 暂无内容
- 暂无内容
-
微生物技术国家重点实验室科普宣讲团, 2024/01/01-2024/10/30
-
木质素定向解聚限速酶分子基础及设计改造子课题, 2023/12/01-2028/11/30
-
药物与人体肺呼吸道互作评价研究, 2023/12/08-2024/12/31
-
半乳糖基转移酶计算设计, 2023/12/06-2024/05/31
-
长效注射剂体外质量评价, 2023/12/06-2024/02/28
-
(包干项目)脂多糖修饰酶EptA对细胞膜脂质相分离的响应机制研究, 2023/08/24-2026/12/31
-
(包干项目)细胞膜系统与抗生素智能设计, 2023/01/01-2025/12/31
-
(包干项目)细菌外膜结构重构介导多粘菌素耐药的分子机制, 2022/11/01-2025/12/30
- 暂无内容