Thoughts on Vectorized Algorithms for Molecular Dynamics

  • D. C. Rapaport
Conference paper
Part of the Springer Proceedings in Physics book series (SPPHY, volume 45)


The nature of the algorithms used in molecular dynamics simulation as well as the benefits and limitations of vector processing are reviewed, and methods for efficiently matching the computations to the computers are discussed.


Data Item Interaction Range Machine Instruction Neighbor List Scalar Computer 
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Copyright information

© Springer-Verlag Berlin Heidelberg 1990

Authors and Affiliations

  • D. C. Rapaport
    • 1
  1. 1.Physics DepartmentBar-Ilan UniversityRamat-GanIsrael

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