A flexible algorithm for calculating pair interactions on SIMD architectures

Computer Physics Communications

Volumn 184, Issue 12, 2013, Pages 2641-2650

  Páll, Szilárd ^a,b   Hess, Berk ^a,b  

^a ROYAL INSTITUTE OF TECHNOLOGY   (Sweden)

^b SCIENCE FOR LIFE LABORATORY   (Sweden)

Author keywords

GPU; Molecular dynamics; Pair interactions; SIMD; Verlet list

Indexed keywords

ACCELERATOR ARCHITECTURES; EFFICIENT IMPLEMENTATION; GPU; MOLECULAR DYNAMICS SIMULATIONS; PAIR INTERACTIONS; SIMD; SINGLE-INSTRUCTION MULTIPLE-DATA; VERLET LIST;

MOLECULAR DYNAMICS; PROGRAM PROCESSORS;

CLUSTERING ALGORITHMS;

EID: 84888294449     PISSN: 00104655     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cpc.2013.06.003     Document Type: Article

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