Undergraduate Program in Computational Chemistry

计算化学本科课程

• 批准号: 9251302
• 负责人: Joseph Ackerman
• 金额: $ 5万
• 依托单位: Washington University
• 依托单位国家: 美国
• 项目类别: Standard Grant
• 财政年份: 1992
• 资助国家: 美国
• 起止时间: 1992-07-01 至 1994-12-31
• 项目状态: 已结题
• 来源: https://www.nsf.gov/awardsearch/showAward?AWD_ID=9251302&HistoricalAwards=false
• 关键词: Undergraduate; Program; Computational; Chemistry

The Department of Chemistry is establishing an Undergraduate Program in Computational Chemistry is providing advanced molecular modeling capabilities enabling undergraduates to explore complex molecular structures and the structure-function relationships inherent in inter-molecular interactions. Molecular modeling is becoming an integral part of the junior level organic chemistry course and the focus of the senior bioorganic course. The facility is also being used extensively by undergraduates enrolled in quantum chemistry to examine how the relation between quantum mechanics and molecular structure is reflected in rotational, vibrational, electronic and magnetic resonance spectra.

化学系正在建立一个本科 计算化学计划提供先进的 分子建模能力，使本科生， 探索复杂的分子结构和结构-功能 分子间相互作用中固有的关系。 分子建模正在成为初级 一级有机化学课程和重点高中 生物有机课程 该设施也被广泛使用 由就读于量子化学的本科生来研究 量子力学与分子结构关系 反映在转动振动电子和 磁共振谱