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计量合成学的产生与发展
引用本文:曾鸽鸣,村松.计量合成学的产生与发展[J].合成化学,1997,5(2):133-140.
作者姓名:曾鸽鸣  村松
作者单位:湖南大学化学化工系,日本国立技科大学工学院,早稻田大学化学与生化系
基金项目:国家自然科学基金,国家教委、机械部与日本文部省及科振会资助
摘    要:对计量合成学的产生与发展及其研究与应用进行了综论,强调了计量化学在合成中的应用,集中在开发有机合成反应的决策及战术方面,通过试验设计对反应体系深入探索及通过自适应建模对试验条件的系统优化和通过综合评价对合成产物的全面考察,将有机反应开发为合成方法,参考文献35篇。

关 键 词:计量合成学  Synthometrics  计量化学  有机合成

Synthometrics:Its Generation and Progress
Li,Zhi Liang Zeng,Ge Ming Xiao,Min Liang,Ben Xi Matsumoto,S. Muramatsu,Y. Hu,Fang.Synthometrics:Its Generation and Progress[J].Chinese Journal of Synthetic Chemistry,1997,5(2):133-140.
Authors:Li  Zhi Liang Zeng  Ge Ming Xiao  Min Liang  Ben Xi Matsumoto  S Muramatsu  Y Hu  Fang
Abstract:A review was made on synthometrics covering its generation, developments, researches and applications. It was highlighted that chemometrics was used in the organic synthesis field, the focus being on strategies and tactics for exploring synthetic reactions and techniques. The role of computers was briefly described in analyzing synthetic pathways. The synthesis was expressed by theme and variations as a metaphor which were reaction and various spaces, respectively. The development of chemical reactions into synthetic methods was illustrated by experimental design for systematic exploration of discrete variation of reaction systems (as reaction/reagent space), and the elaboration of optimization of continous domain of the experimental conditions (as experimental condition space). In this field, chemometrics play an important role in solving some complecated synthetic problems. 35 cited references are presented.
Keywords:Synthetic chemistry  Organic synthesis  Chemometrics  Synthometrics  Synthetometrics  Review    
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