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Development and evaluation of two-parameter linear free energy models for the prediction of human skin permeability coefficient of neutral organic chemicals.
Sana Naseem
Yasuyuki Zushi
Deedar Nabi
Published in:
J. Cheminformatics (2021)
Keyphrases
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human skin
free energy
experimental data
probabilistic model
neural network
computer vision
dynamic programming
model selection
dynamical systems
fixed point
hyperparameters