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Normal Boiling Points for Organic Compounds: Correlation and Prediction by a Quantitative Structure-Property Relationship.
Alan R. Katritzky
Victor S. Lobanov
Mati Karelson
Published in:
J. Chem. Inf. Comput. Sci. (1998)
Keyphrases
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prediction accuracy
point sets
prediction model
neural network
qualitative and quantitative
data sets
high dimensional
hierarchical structure
structural information
predictive modeling
linear relationship
negative correlation