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Correlating the vibrational spectra of structurally related molecules: A spectroscopic measure of similarity.
Yunwen Tao
Wenli Zou
Dieter Cremer
Elfi Kraka
Published in:
J. Comput. Chem. (2018)
Keyphrases
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similarity measure
distance measure
similarity coefficient
similarity metric
genetic algorithm
high dimensional
closely related
similarity function
database
principal component analysis
information theory
dissimilarity measure
similarity measurement
similarity metrics