Analysis of the structure and vibrational spectra of glucose and fructose
Molecular modelling using semiempirical methods AM1, PM3, PM5 and, MINDO as well as the Density Functional Theory method BLYP/DZVP respectively were used to calculate the struc- ture and vibrational spectra of d-glucose and d-fructose in their open chain, α-anomer and β-anomer monohydrate forms. The...
Main Authors: | , , , , |
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Format: | Article |
Language: | English |
Published: |
Universidade Estadual Paulista
2018-05-01
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Series: | Eclética Química |
Online Access: | https://revista.iq.unesp.br/ojs/index.php/ecletica/article/view/424 |