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"Zwitterionic Proton Sponge" Hydrogen Bonding Investigations on the Basis of Car-Parrinello Molecular Dynamics.
Aneta Jezierska
Jaroslaw J. Panek
Published in:
J. Chem. Inf. Model. (2015)
Keyphrases
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molecular dynamics
high performance computing
scientific data
molecular dynamics simulations
protein folding