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molecules.
Yunfei Zhou
Xiaoguang Bao
Weston Thatcher Borden
Published in:
J. Comput. Chem. (2016)
Keyphrases
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real world
molecular interactions
molecular structure
digital libraries
pattern recognition
search algorithm
cooperative
ligand docking
chemical reactions
preprocessing
data sets
multiscale
training data
three dimensional
knowledge base
feature selection
databases