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The comparison of automated clustering algorithms for resampling representative conformer ensembles with RMSD matrix.
Hyoungrae Kim
Cheongyun Jang
Dharmendra Kumar Yadav
Mi-Hyun Kim
Published in:
J. Cheminformatics (2017)
Keyphrases
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clustering algorithm
decision trees
data clustering
semi automated
unsupervised clustering
k means
clustering method
image segmentation
multi class
fuzzy clustering
fuzzy c means
root mean square