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An extension of the grid empowered molecular simulator to quantum reactive scattering.
Sergio Rampino
Noelia Faginas Lago
Antonio Laganà
Fermín Huarte-Larrañaga
Published in:
J. Comput. Chem. (2012)
Keyphrases
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three dimensional
grid points
grid computing
database
social networks
knowledge base
load balancing
agent architecture
drug discovery
computational grids
quantum computing
grid enabled
quantum computation