Molecular Factor Computing for Predictive Spectroscopy

@article{Dai2007MolecularFC,
  title={Molecular Factor Computing for Predictive Spectroscopy},
  author={Bin Dai and A. Urbas and C. Douglas and R. Lodder},
  journal={Pharmaceutical Research},
  year={2007},
  volume={24},
  pages={1441-1449}
}
PurposeThe concept of molecular factor computing (MFC)-based predictive spectroscopy was demonstrated here with quantitative analysis of ethanol-in-water mixtures in a MFC-based prototype instrument. MethodsMolecular computing of vectors for transformation matrices enabled spectra to be represented in a desired coordinate system. New coordinate systems were selected to reduce the dimensionality of the spectral hyperspace and simplify the mechanical/electrical/computational construction of a new… Expand
Filter design for molecular factor computing using wavelet functions.
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