5 records found
1
A quantum mechanics-based approach for optimization of metabolite basis-sets. Application to quantitation of HRMAS-NMR signals
Optimization of metabolite basis sets prior to quantitation in magnetic resonance spectroscopy: An approach based on quantum mechanics
DFT calculations of iH NMR chemical shifts, simulated and experimental spectra of sarcosine
Simple correction of chemical shift changes in magnetic resonance spectroscopy quantitation
Quantitation of magnetic resonance spectroscopy signals: The jMRUI software package