A parallel molecular dynamics simulation code for dialkyl cationic surfactants

We have developed a new simulation code, COMFORT, for the study of assemblies of flexible surfactant molecules, structured for parallel execution and specialised to surfactants with dialkyl chain geometry. The approach is a hybrid domain-decomposition and systolic-loop algorithm which is suitable fo...

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Veröffentlicht in:	Parallel computing 1996-10, Vol.22 (8), p.1053-1071
Hauptverfasser:	Surridge, M., Tildesley, D.J., Kong, Y.C., Adolf, D.B.
Format:	Artikel
Sprache:	eng
Schlagworte:	Implementation Molecular dynamics Parallel architectures Portability Simulation Workstation clusters
Online-Zugang:	Volltext
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