Vibrational self-consistent field calculations for spectroscopy of biological molecules: new algorithmic developments and applications
This review describes the vibrational self-consistent field (VSCF) method and its other
variants for computing anharmonic vibrational spectroscopy of biological molecules. The …
variants for computing anharmonic vibrational spectroscopy of biological molecules. The …
Microwave spectroscopy of biomolecular building blocks
JL Alonso, JC López - Gas-Phase IR Spectroscopy and Structure of …, 2015 - Springer
Microwave spectroscopy, considered as the most definitive gas phase structural probe, is
able to distinguish between different conformational structures of a molecule, because they …
able to distinguish between different conformational structures of a molecule, because they …
The conformational behaviour of free D-glucose—at last
The conformational behaviour of isolated D-glucose has been revealed in this work using
Fourier transform microwave spectroscopy coupled with laser ablation of crystalline α-and β …
Fourier transform microwave spectroscopy coupled with laser ablation of crystalline α-and β …
Eco-friendly and cost-effective synthesis of ZnO nanopowders by Tapioca-assisted sol-gel route
This study presents a low-cost method for obtaining nanometric zinc oxide (ZnO) using a
cassava starch (Tapioca)-assisted by sol-gel route. In this procedure, ZnO nanopowders …
cassava starch (Tapioca)-assisted by sol-gel route. In this procedure, ZnO nanopowders …
Adsorption and reactivity of cellulosic aldoses on transition metals
The adsorption of cellulosic biomass derived aldoses on heterogeneous catalysts is the first
and governing step in their conversion to platform chemicals. However, there is a …
and governing step in their conversion to platform chemicals. However, there is a …
Mid-infrared photoacoustic spectroscopy using a quantum cascade laser for non-invasive blood component analysis
M Maeno, S Kino, Y Matsuura - Japanese Journal of Applied …, 2023 - iopscience.iop.org
We developed a photoacoustic spectroscopic method using mid-IR light for non-invasive
analysis of blood components in living bodies. The ultra-low-volume photoacoustic cell …
analysis of blood components in living bodies. The ultra-low-volume photoacoustic cell …
Vibrational spectra of α-glucose, β-glucose, and sucrose: anharmonic calculations and experiment
B Brauer, M Pincu, V Buch, I Bar… - The Journal of …, 2011 - ACS Publications
The anharmonic vibrational spectra of α-d-glucose, β-d-glucose, and sucrose are computed
by the vibrational self-consistent field (VSCF) method, using potential energy surfaces from …
by the vibrational self-consistent field (VSCF) method, using potential energy surfaces from …
Spectroscopic investigation of the impact of cold plasma treatment at atmospheric pressure on sucrose and glucose
When exposing food and feedstuff to cold atmospheric pressure plasmas (CAPP), eg, for
decontamination purposes, possible unwanted effects on the contained nutrients might …
decontamination purposes, possible unwanted effects on the contained nutrients might …
Mechanism and theory of d-glucopyranose homogeneous acid catalysis in the aqueous solution phase
A detailed systematic theoretical study of the mechanism of the homogeneous Brønsted-acid
catalysis of D-glucose in aqueous solution phase (“acid hydrolysis”) is reported. G4MP2 with …
catalysis of D-glucose in aqueous solution phase (“acid hydrolysis”) is reported. G4MP2 with …
[BOOK][B] Physics and chemistry at low temperatures
L Khriachtchev - 2019 - books.google.com
Tunneling reactions in chemistry are characterized by the low-temperature limit when the
classical contribution is negligible. Many practical applications benefit from the lack of heat …
classical contribution is negligible. Many practical applications benefit from the lack of heat …