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Computer-assisted methods for molecular structure elucidation: realizing a spectroscopist's dream

BACKGROUND: This article coincides with the 40 year anniversary of the first published works devoted to the creation of algorithms for computer-aided structure elucidation (CASE). The general principles on which CASE methods are based will be reviewed and the present state of the art in this field w...

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Main Authors: Elyashberg, Mikhail, Blinov, Kirill, Molodtsov, Sergey, Smurnyy, Yegor, Williams, Antony J, Churanova, Tatiana
Formato: Artigo
Idioma:Inglês
Publicado: Springer 2009
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Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC2816863/
https://ncbi.nlm.nih.gov/pubmed/20142986
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1758-2946-1-3
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