一、引言用数学、物理的模型探索合成“新奇”分子,或借鉴它们的术语描述结构,或求助哲学的原理揭示其间的规律,这四位一体(数、理、哲与化学)的研究模式已是近代化学的特征之一。“拓扑学是否可以做为分子结构与活性的理论基础?”,Wolovsky,Ben-Efraim,Walba等的工作已经在实验上做出了初步的回答。 I. INTRODUCTION The four in one (mathematical, theoretical, philosophical and chemical) mode of research was explored using mathematical and physical models to explore the synthesis of “novelty” molecules, or to use their terms to describe structures, or to turn to philosophical principles to reveal the laws in between. It is one of the characteristics of modern chemistry. “Can topology be the theoretical basis for molecular structure and activity?”, Wolovsky, Ben-Efraim, Walba, and others have tentatively answered the question.