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quantum mechanical charge field molecular dynamics simulation of a dilute aqueous HCl solution.
Chinapong Kritayakornupong
Viwat Vchirawongkwin
Bernd M. Rode
Published in:
J. Comput. Chem. (2010)
Keyphrases
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molecular dynamics
molecular dynamics simulations
mathematical model
high performance computing
scientific data
quantum mechanics
databases
protein folding
fluid flow
distributed systems