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Efficient Approximation of Ligand Rotational and Translational Entropy Changes upon Binding for Use in MM-PBSA Calculations.
Ido Y. Ben-Shalom
Stefania Pfeiffer-Marek
Karl-Heinz Baringhaus
Holger Gohlke
Published in:
J. Chem. Inf. Model. (2017)
Keyphrases
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information theory
approximation algorithms
computer vision
decision trees
cost effective
rms error