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EMCSS: A new method for maximal common substructure search
Alternative TitleJ. Chem. Inf. Comput. Sci.
Wang, T; Zhou, JJ
1997-09-01
Source PublicationJOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES
ISSN0095-2338
Volume37Issue:5Pages:828-834
AbstractThis paper describes a new method-EMCSS for Maximal Common Substructure (MCS) search, which uses a substructure searching algorithm: Xu's GMA algorithm converts the MCS search space into a much smaller space, the connection table space of query graph (Qc), and adopts a evolutionary strategy to search the optimum solution. The principle of the EMCSS method and its implementation are described in detail. Some highly complex examples, even a hyperstructure pair, are tested. The investigation demonstrates that the EMCSS method is robust and efficient.; This paper describes a new method-EMCSS for Maximal Common Substructure (MCS) search, which uses a substructure searching algorithm: Xu's GMA algorithm converts the MCS search space into a much smaller space, the connection table space of query graph (Qc), and adopts a evolutionary strategy to search the optimum solution. The principle of the EMCSS method and its implementation are described in detail. Some highly complex examples, even a hyperstructure pair, are tested. The investigation demonstrates that the EMCSS method is robust and efficient.
KeywordGenetic Algorithms Identification Isomorphism Perception Selection Mcss
SubtypeArticle
WOS HeadingsScience & Technology ; Physical Sciences ; Technology
URL查看原文
Indexed BySCI
Language英语
WOS KeywordGENETIC ALGORITHMS ; IDENTIFICATION ; ISOMORPHISM ; PERCEPTION ; SELECTION ; MCSS
WOS Research AreaChemistry ; Computer Science
WOS SubjectChemistry, Multidisciplinary ; Computer Science, Information Systems ; Computer Science, Interdisciplinary Applications
WOS IDWOS:A1997XX69000002
Citation statistics
Cited Times:18[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Version出版稿
Identifierhttp://ir.ipe.ac.cn/handle/122111/5914
Collection研究所(批量导入)
AffiliationCHINESE ACAD SCI,INST CHEM MET,LAB COMP CHEM,BEIJING 100080,PEOPLES R CHINA
Recommended Citation
GB/T 7714
Wang, T,Zhou, JJ. EMCSS: A new method for maximal common substructure search[J]. JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES,1997,37(5):828-834.
APA Wang, T,&Zhou, JJ.(1997).EMCSS: A new method for maximal common substructure search.JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES,37(5),828-834.
MLA Wang, T,et al."EMCSS: A new method for maximal common substructure search".JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 37.5(1997):828-834.
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