The Impact of Docking Pose Generation Error on the Prediction of Binding Affinity.

Hongjian Li Kwong-Sak Leung Man Hon Wong Pedro J. Ballester

Published in: CIBB (2014)

Keyphrases

prediction error
hiv protease
prediction accuracy
error rate
prediction model
coarse grained
generation method
d objects
pose estimation
root mean square error
general loss functions
neural network
pose variations
generation process
extreme values
major histocompatibility complex