Use of the computer for the solution of structural problems in organic chemistry by the methods of molecular spectroscopy

Koptyug, V. A.; Bochkarev, V. S.; Deendyaev, B. G.; Nekhoroshev, S. A.; Piottukh-Peletskii, V. N.; Podgornaya, M. I.; Ul'yanov, G. P.

doi:10.1007/bf00753084

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1981

1988

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“…Some examples are CIS of NIH/EPA,1•2 Pluridata in the DARC system,3 and a retrieval system developed by Koptyung and co-workers. 4 These systems integrate large spectrometric data bases of tens of thousands of spectra as well as related structural data bases.…”

Section: Introductionmentioning

confidence: 99%

“…Table I lists various types of queries and typical search methods, showing that present DBMS support the queries listed in columns 1 and 3. In contrast, the queries raised frequently with respect to spectrometric and structural data bases are those in columns 4 and 5, sometimes simplified to those listed in column 2 for presearch purposes. Thus, the DBMS are of limited utility for spectral library searches.…”

Section: Introductionmentioning

confidence: 99%

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