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STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM
Alternative TitleJ. Chem. Inf. Comput. Sci.
ZHOU, JJ; XIE, Q; SUN, DM; XIE, GR; CAO, LX; XU, ZH
1993-05-01
Source PublicationJOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES
ISSN0095-2338
Volume33Issue:3Pages:310-319
AbstractAn overview of the project ''Computer-Aided Molecular Design of Pesticide'' running in LCC, Chinese Academy of Sciences, is presented. In this paper, the authors propose a structural frame model (SFM) method for numeralization of structural factors and report a user-friendly software named ''Computer-Aided Screening of Agricultural Chemicals' (CASAC) developed by LCC, including a prototype of structure-activity database (S-ADB) to support SAR/QSAR studies and computer-aided molecular design. Some typical case studies on herbicides, insecticides, and chemical hybridizing agents have been represented. The paper is focused on the SFM method for superimposing structural information and noteworthy functions of the CASAC system (version 1991).; An overview of the project ''Computer-Aided Molecular Design of Pesticide'' running in LCC, Chinese Academy of Sciences, is presented. In this paper, the authors propose a structural frame model (SFM) method for numeralization of structural factors and report a user-friendly software named ''Computer-Aided Screening of Agricultural Chemicals' (CASAC) developed by LCC, including a prototype of structure-activity database (S-ADB) to support SAR/QSAR studies and computer-aided molecular design. Some typical case studies on herbicides, insecticides, and chemical hybridizing agents have been represented. The paper is focused on the SFM method for superimposing structural information and noteworthy functions of the CASAC system (version 1991).
SubtypeArticle
WOS HeadingsScience & Technology ; Physical Sciences ; Technology
URL查看原文
Indexed BySCI
Language英语
WOS Research AreaChemistry ; Computer Science
WOS SubjectChemistry, Multidisciplinary ; Computer Science, Information Systems ; Computer Science, Interdisciplinary Applications
WOS IDWOS:A1993LE40700006
Citation statistics
Cited Times:5[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Version出版稿
Identifierhttp://ir.ipe.ac.cn/handle/122111/7988
Collection研究所(批量导入)
Recommended Citation
GB/T 7714
ZHOU, JJ,XIE, Q,SUN, DM,et al. STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM[J]. JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES,1993,33(3):310-319.
APA ZHOU, JJ,XIE, Q,SUN, DM,XIE, GR,CAO, LX,&XU, ZH.(1993).STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM.JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES,33(3),310-319.
MLA ZHOU, JJ,et al."STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM".JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES 33.3(1993):310-319.
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