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Hydration free energies calculated using the AMBER ff03 charge model for natural and unnatural amino acids and multiple water models.
George A. Khoury
Nikita Bhatia
Christodoulos A. Floudas
Published in:
Comput. Chem. Eng. (2014)
Keyphrases
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probabilistic model
statistical model
experimental data
multiple models
statistical models
amino acids
autoregressive
pairwise
energy function
protein sequences