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Tackling Exascale Software Challenges in Molecular Dynamics Simulations with GROMACS.
Szilárd Páll
Mark James Abraham
Carsten Kutzner
Berk Hess
Erik Lindahl
Published in:
EASC (2014)
Keyphrases
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protein folding
molecular dynamics
molecular dynamics simulations
high performance computing
software systems
software development
scientific computing
wireless sensor networks
source code
computer systems
databases
cost effective
software developers