International Journal

GROMACS: A message-passing parallel molecular dynamics implementation

Herman J. C. Berendsen, David van der Spoel, Rudi van Drunen

Computer Physics Communications

1995

Elsevier BV

10407 citations

Article

Message passing (0.68) Computer science (0.64) Parallel computing (0.52) Message Passing Interface (0.48) Dynamics (music) (0.48)

GROMACS: A message-passing parallel molecular dynamics implementation - Full text available via OpenAlex

Herman J. C. Berendsen

David van der Spoel

ORCID

Rudi van Drunen

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