Efficient parallel algorithms for molecular dynamics simulations

DOI10.1016/S0167-8191(98)00114-8zbMath0914.68091MaRDI QIDQ1285681

Ravi Murty, Daniel I. Okunbor

Publication date: 28 April 1999

Published in: Parallel Computing (Search for Journal in Brave)

zbMATH Keywords

parallel algorithmsmolecular dynamicsStörmer-Verlet methodforce decomposition

Mathematics Subject Classification ID

Distributed algorithms (68W15)

Related Items

Parallel SPH modeling using dynamic domain decomposition and load balancing displacement of Voronoi subdomains ⋮ A domain decomposition molecular dynamics program for the simulation of flexible molecules with an arbitrary topology of Lennard-Jones and/or Gay-Berne sites ⋮ Algorithm optimization in molecular dynamics simulation ⋮ Parallel algorithms for molecular dynamics with induction forces ⋮ Interconnection networks for parallel molecular dynamics simulation based on Hamiltonian cubic symmetric topology

Uses Software

• MPI