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Incorporating structural similarity into a scoring function to enhance the prediction of binding affinities.
Beihong Ji
Xibing He
Yuzhao Zhang
Jingchen Zhai
Viet Hoang Man
Shuhan Liu
Junmei Wang
Published in:
J. Cheminformatics (2021)
Keyphrases
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structural similarity
scoring function
structural information
structure learning
quality metrics
ranking functions
scoring functions
information retrieval
pairwise
correlation coefficient
training set
bayesian networks
xml documents
quality assessment