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Prolog-based functional group perception and calculation of 1-octanol/water partition coefficients using Rekker's fragment method.
Kei Takeuchi
Chiaki Kuroda
Masaru Ishida
Published in:
J. Chem. Inf. Comput. Sci. (1990)
Keyphrases
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basis functions
significant improvement
computational cost
clustering method
preprocessing
high accuracy
data sets
neural network
expert systems
support vector machine svm
high precision
high resolution
optimization algorithm
detection method
synthetic data
pixel values