Automorphism group algorithm in computer-aided structure elucidation

	Automorphism group algorithm in computer-aided structure elucidation
	Hao JF ; Lu X
刊名	chinese journal of analytical chemistry
	2000
卷号	28 期号:10 页码:1209-1213
关键词	CONNECTIVITIES HOC PROCEDURES CHEMICAL STRUCTURES UNIQUE DESCRIPTION PERCEPTION
ISSN号	0253-3820
通讯作者	lu x
中文摘要	it is necessary to generate automorphism group of chemical graph in computer-aided structure eluciation. in this paper, an algorithm is developed by all-path topological symmetry algorithm to build automorphism group of chemical graph. a comparison of several topological symmetry algorithm reveals that all-path algorthm can yield correct of class of chemical graph. it lays a foundation for esesoc system for computer-aided structure elucidation.
收录类别	SCI收录期刊论文
语种	中文
WOS记录号	WOS:000165083400005
公开日期	2010-11-04
内容类型	期刊论文
源URL	[http://202.98.16.49/handle/322003/19495]
专题	长春应用化学研究所_长春应用化学研究所知识产出_期刊论文
推荐引用方式 GB/T 7714	Hao JF,Lu X. Automorphism group algorithm in computer-aided structure elucidation[J]. chinese journal of analytical chemistry,2000,28(10):1209-1213.
APA	Hao JF,&Lu X.(2000).Automorphism group algorithm in computer-aided structure elucidation.chinese journal of analytical chemistry,28(10),1209-1213.
MLA	Hao JF,et al."Automorphism group algorithm in computer-aided structure elucidation".chinese journal of analytical chemistry 28.10(2000):1209-1213.