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A vision transformer with recurrent neural network-based fall activity recognition system for disabled persons in smart IoT environments. [PDF]
Sci RepAlzahrani A, Alghamdi AM.
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Computer-assisted structure elucidation
Fresenius' Zeitschrift für analytische Chemie, 1982Program case, an evolving computer model of the structure elucidation process, treats three major tasks: reduction of chemical and spectral properties to their structural implications, generation of complete molecular structures compatible with the structural features identified, and ranking these structures by comparing predicted and observed spectral
Morton E. Munk +3 more
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ChemInform Abstract: Computer‐Assisted Structure Elucidation
ChemInform, 1992AbstractChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a “Full Text” option. The original article is trackable via the “References” option.
L. CHEN, M. ZHANG
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Automated classification of candidate structures for computer-assisted structure elucidation
Journal of Chemical Information and Computer Sciences, 1988In computer-assisted structure elucidation, a large number of candidate structures for the unknown compound can be generated. A computer program designed to aid in the recognition of significant differences between these structures is described. The goal of the program is to group the candidates into meaningful classes with a minimum of input from the ...
A H, Lipkus, M E, Munk
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Structure Revision of Asperjinone Using Computer-Assisted Structure Elucidation Methods
Journal of Natural Products, 2013The elucidated structure of asperjinone (1), a natural product isolated from thermophilic Aspergillus terreus, was revised using the expert system Structure Elucidator. The reliability of the revised structure (2) was confirmed using 180 structures containing the (3,3-dimethyloxiran-2-yl)methyl fragment (3) as a basis for comparison and whose chemical ...
Mikhail, Elyashberg +3 more
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Computer-Assisted Structure Elucidation
2007This article describes NMR approaches to determine the molecular structure of a small organic molecule. The use of one- and two-dimensional spectra is described. The proton and carbon shifts determined are used to identify the best molecular matches among more than 30 million PubChem structures. Molecular carbon skeletons can be generated from 2-D homo-
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Are Deterministic Expert Systems for Computer‐Assisted Structure Elucidation Obsolete?
ChemInform, 2006AbstractChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 200 leading journals. To access a ChemInform Abstract, please click on HTML or PDF.
Mikhail E, Elyashberg +4 more
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Computer‐assisted elucidation of structures of natural products
Phytochemical Analysis, 1992AbstractAn historical survey of the first computer programs capable of handling spectroscopic data and of transforming them into possible molecular structures is exemplified by some applications. Technological improvements of nuclear magnetic resonance spectroscopy now allow the direct collection of connectivity relationships between atoms, and the ...
G. Massiot, J. M. Nuzillard
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Computer-Assisted Approach to Structural Elucidation of Lignans
Spectroscopy Letters, 2008ABSTRACT This paper reports an expert system (SISTEMAT) developed for structural determination of diverse chemical classes of natural products, including lignans, based mainly on 13C NMR and 1H NMR data of these compounds. The system is composed of five programs that analyze specific data of a lignan and shows a skeleton probability for the compound ...
Mara B. Costantin +3 more
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