物理化学学报 >> 1998, Vol. 14 >> Issue (08): 676-681.doi: 10.3866/PKU.WHXB19980802
通讯 上一篇 下一篇
何险峰, 周家驹
收稿日期:
修回日期:
发布日期:
通讯作者:
He Xian-Feng, Zhou Jia-Ju
Received:
Revised:
Published:
Contact:
关键词: 拓扑指数, 联接矩阵
Abstract:
By the use of ordering-tree and connectivity matrix, a new algorithm to code non-circle molecules, called connectivity matrix polynomial (CMP) algorithm, is developed. The algorithm can not only differentiate asymmetrical atoms. but also make the two-direction mapping between codes and non-circle molecular structures. That is, from the molecular structure, a unique code can be obtained, and from the unique code, the specific molecular structure can be derived
Key words: Topological index, Connectivity matrix
何险峰, 周家驹. 对无环分子编码的一个新方法:CMP法[J]. 物理化学学报, 1998, 14(08): 676-681.
He Xian-Feng, Zhou Jia-Ju. A New Method to Code Non-circle Molecules: CMP Algorithm[J]. Acta Phys. -Chim. Sin., 1998, 14(08): 676-681.
0 /
导出引用管理器 EndNote (中文内容)|EndNote (英文内容)| Reference Manager|ProCite|BibTeX|RefWorks
链接本文: http://www.whxb.pku.edu.cn/CN/10.3866/PKU.WHXB19980802
http://www.whxb.pku.edu.cn/CN/Y1998/V14/I08/676
Cited