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Evaluation of a knowledge-based potential of mean force for scoring docked protein-ligand complexes.
Irene Nobeli
John B. O. Mitchell
Alexander Alex
Janet M. Thornton
Published in:
J. Comput. Chem. (2001)
Keyphrases
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drug design
neural network
protein sequences
evaluation method
drug discovery
protein complexes
protein protein
data sets
protein structure
evaluation model
virtual screening
data mining
computational methods
protein structure prediction
scoring methods