STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM

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	STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM
	Zhou, J. J. ; Xie, Q. ; Sun, D. M. ; Xie, G. R. ; Cao, L. X. ; Xu, Z. H.
刊名	Journal of Chemical Information and Computer Sciences
	1993
期号	3 页码:310-319
其他题名	J. Chem. Inf. Comput. Sci.
中文摘要	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).
收录类别	SCI
原文出处	://WOS:A1993LE40700006
语种	英语
公开日期	2014-03-14
内容类型	期刊论文
版本	出版稿
源URL	[http://ir.ipe.ac.cn/handle/122111/7988]
专题	过程工程研究所_研究所（批量导入）
推荐引用方式 GB/T 7714	Zhou, J. J.,Xie, Q.,Sun, D. M.,et al. STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM[J]. Journal of Chemical Information and Computer Sciences,1993(3):310-319.
APA	Zhou, J. J.,Xie, Q.,Sun, D. M.,Xie, G. R.,Cao, L. X.,&Xu, Z. H..(1993).STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM.Journal of Chemical Information and Computer Sciences(3),310-319.
MLA	Zhou, J. J.,et al."STRUCTURE-ACTIVITY-RELATIONSHIPS ON PESTICIDES - A DEVELOPMENT IN METHODOLOGY AND ITS SOFTWARE SYSTEM".Journal of Chemical Information and Computer Sciences .3(1993):310-319.