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Titlebook: Chemical Structures 2; The International La Wendy A. Warr Conference proceedings 1993 Springer-Verlag Berlin Heidelberg 1993 Atom.Chemical

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书目名称Chemical Structures 2
副标题The International La
编辑Wendy A. Warr
视频video
图书封面Titlebook: Chemical Structures 2; The International La Wendy A. Warr Conference proceedings 1993 Springer-Verlag Berlin Heidelberg 1993 Atom.Chemical
描述This book constitutes the Proceedings of the second conference in the series ‘Chemical Structures: The International Language of Chemistry‘ which was held at Leeuwenhorst Congress Centre, Noordwijkerhout, in the Netherlands, between June 3 and June 7, 1990. The conference was jointly sponsored by the Chemical Structure Association; the American Chemical Society Division of Chemical Information; the Royal Netherlands Chemical Society; and the Chemical Infor­ mation Groups of the Royal Society of Chemistry and the German Chemical Society. The purpose of the conference was to bring together experts and an international professional audience to discuss and to further basic and applied research and development in the processing, storage, retrieval, and use of chemical structures; to focus international attention on the importance of chemical information and the vital research being carried out in chemical information science; and to foster co­ operation among major chemical information organisations throughout the world. Subjects covered included structure-property correlations, spectral database systems, chemical nomenclature, generic structures, stereochemistry, substructure search sy
出版日期Conference proceedings 1993
关键词Atom; Chemical reaction; Datenverarbeitung; Hardware; chemical structure; chemistry; computer; crystal; data
版次1
doihttps://doi.org/10.1007/978-3-642-78027-1
isbn_softcover978-3-642-78029-5
isbn_ebook978-3-642-78027-1
copyrightSpringer-Verlag Berlin Heidelberg 1993
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A Hierarchy of the Structure of Matter from the Viewpoint of Information Retrieval and Structure-Prfication at the areas relevant to chemical information retrieval, structure-property correlations, especially related to the design of bioactive molecules. The chart covers small to large scale and low to higher resolution. It points out some of the parallels between man-made (e.g., drug, transistor
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,AUTONOM — A Chemist’s Dream: System for (Micro)Computer Generation of IUPAC-Compatible Names from Sdiagrams of organic compounds into chemical names. The algorithm designed for AUTONOM operates on structure diagrams entered . a structure drawing package and generates names exclusively on the basis of the connection tables of the input structures. The IUPAC rules have been adopted as the basis of
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Automatic Translation of GENSAL Representations of Markush Structures into Gremas Fragment Codes ates, substructures and other information in this large database. Until now, the GREMAS fragment codes of generic chemical structures had to be derived manually. Using the formal language GENSAL for the description and graphical input of generic chemical structures, we are able to process them by a co
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