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An Alignment-Independent Versatile Structure Descriptor for QSAR and QSPR Based on the Distribution of Molecular Features.
Knut Baumann
Published in:
J. Chem. Inf. Comput. Sci. (2002)
Keyphrases
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drug discovery
structural information
spatial distribution
feature extraction
feature representation
geometric consistency
image descriptors
low level
shape descriptors
structural features
feature descriptors
discriminatory power
drug design
keypoints
image features
feature vectors
feature space
similarity measure