Upgrade of Computer Facility for Molecular Modeling in Biology and Chemistry

生物和化学分子模拟计算机设备升级

• 批准号: 8908054
• 负责人: Jan Hermans
• 金额: $ 25.61万
• 依托单位: University of North Carolina at Chapel Hill
• 依托单位国家: 美国
• 项目类别: Standard Grant
• 财政年份: 1989
• 资助国家: 美国
• 起止时间: 1989-12-01 至 1992-05-31
• 项目状态: 已结题
• 来源: https://www.nsf.gov/awardsearch/showAward?AWD_ID=8908054&HistoricalAwards=false
• 关键词: Upgrade; Computer; Facility; Molecular; Modeling

The computer system at the University of North Carolina-Chapel Hill will be upgraded to support research which emphasizes quantum mechanics and molecular dynamics in understanding molecular structure and biological activity. Specific projects include: 1) fundamental physical problems of molecular structure, 2) physical chemistry of molecular interactions in aqueous solution, 3) problem related to protein folding and the stability of folding conformations and 4) conformation of proteins of the hemostatic pathway.

北卡罗来纳大学查珀尔分校的计算机系统 希尔将升级，以支持研究，强调 量子力学和分子动力学 分子结构和生物活性。 具体项目 包括：1）分子的基本物理问题 结构，2）分子相互作用的物理化学， 水溶液，3）与蛋白质折叠和 折叠构象的稳定性和4）构象的 止血途径的蛋白质。