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Accounting for Intraligand Interactions in Flexible Ligand Docking with a PMF-Based Scoring Function.
A. Y. Lizunov
A. L. Gonchar
Natalia Zaitseva
Viktor Zosimov
Published in:
J. Chem. Inf. Model. (2015)
Keyphrases
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scoring function
ligand docking
scoring functions
structure learning
ranking functions
data sets
digital libraries
training set
higher order