Data-Driven Prediction of Circular Dichroism-Based Calibration Curves for the Rapid Screening of Chiral Primary Amine Enantiomeric Excess Values.
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DOI: 10.1021/jacs.2c08127
Abstract: Here, we describe the prediction of the circular dichroism (CD) response of a three-component chiroptical sensor for enantiomeric excess (ee) determination of chiral amines using a multivariate fit to electronic and steric parameters. These computationally… read more here.
Keywords: calibration; prediction circular; calibration curves; enantiomeric excess ... See more keywords