GROMACS: A message-passing parallel molecular dynamics implementation

1995/09/01 by H.J.C. Berendsen, Herman J. C. Berendsen, D. van der Spoel +3 · 10,586 citations
Biochemistry, Genetics and Molecular Biology · Physics and Astronomy · #Advanced Chemical Physics Studies #Computational science #Computer science #Dynamics (music) #Message Passing Interface #Message passing #Molecular dynamics #Parallel computing #Physics #Protein Structure and Dynamics #Spectroscopy and Quantum Chemical Studies

paper · doi:10.1016/0010-4655(95)00042-e

published in Computer Physics Communications 91(1-3), 43-56 (Elsevier BV)

openalex publication_date 1995/09/01 · openalex created_date 2025/10/10 · openalex updated_date 2026/08/05

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