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Pregled bibliografske jedinice broj: 989426

Packing Density Insensitive Contact Detection Algorithm for Molecular Dynamics Simulations

Munjiza, A;
Packing Density Insensitive Contact Detection Algorithm for Molecular Dynamics Simulations // ASME 2008 9th Biennial Conference on Engineering Systems Design and Analysis
Haifa, 2008. 9100, 11 (predavanje, međunarodna recenzija, cjeloviti rad (in extenso), znanstveni)

CROSBI ID: 989426 Za ispravke kontaktirajte CROSBI podršku putem web obrasca

Naslov
Packing Density Insensitive Contact Detection Algorithm for Molecular Dynamics Simulations

Autori
Munjiza, A ;

Vrsta, podvrsta i kategorija rada
Radovi u zbornicima skupova, cjeloviti rad (in extenso), znanstveni

Izvornik
ASME 2008 9th Biennial Conference on Engineering Systems Design and Analysis / - Haifa, 2008

Skup
9th biennial ASME conference on engineering systems design and analysis

Mjesto i datum
Haifa, Izrael, 07.07.2008. - 09.07.2008

Vrsta sudjelovanja
Predavanje

Vrsta recenzije
Međunarodna recenzija

Ključne riječi
contact detection molecular dynamics

Sažetak
Molecular dynamics problems involve large numbers of interacting atoms requiring CPU and RAM intensive computational simulations. A contact detection algorithm which detects pairs of interacting atoms is a key component of these simulations. This paper presents a contact detection algorithm that is completely insensitive to packing density in terms of both RAM and CPU requirements — thus permitting near vacuum conditions and dense gases or liquids to coexist in the same simulation. In addition, both CPU and RAM requirements are proportional to the total number of atoms.

Izvorni jezik
Engleski

Znanstvena područja
Interdisciplinarne prirodne znanosti, Interdisciplinarne tehničke znanosti, Interdisciplinarne biotehničke znanosti



POVEZANOST RADA

Ustanove:
Fakultet građevinarstva, arhitekture i geodezije, Split,
Hrvatska akademija znanosti i umjetnosti

Profili:

Avatar Url Ante Munjiza (autor)

Citiraj ovu publikaciju:

Munjiza, A;
Packing Density Insensitive Contact Detection Algorithm for Molecular Dynamics Simulations // ASME 2008 9th Biennial Conference on Engineering Systems Design and Analysis
Haifa, 2008. 9100, 11 (predavanje, međunarodna recenzija, cjeloviti rad (in extenso), znanstveni)
Munjiza, A. & (2008) Packing Density Insensitive Contact Detection Algorithm for Molecular Dynamics Simulations. U: ASME 2008 9th Biennial Conference on Engineering Systems Design and Analysis.
@article{article, author = {Munjiza, A}, year = {2008}, pages = {11}, chapter = {9100}, keywords = {contact detection molecular dynamics}, title = {Packing Density Insensitive Contact Detection Algorithm for Molecular Dynamics Simulations}, keyword = {contact detection molecular dynamics}, publisherplace = {Haifa, Izrael}, chapternumber = {9100} }
@article{article, author = {Munjiza, A}, year = {2008}, pages = {11}, chapter = {9100}, keywords = {contact detection molecular dynamics}, title = {Packing Density Insensitive Contact Detection Algorithm for Molecular Dynamics Simulations}, keyword = {contact detection molecular dynamics}, publisherplace = {Haifa, Izrael}, chapternumber = {9100} }

Časopis indeksira:


  • Current Contents Connect (CCC)
  • Web of Science Core Collection (WoSCC)
    • Science Citation Index Expanded (SCI-EXP)
    • Conference Proceedings Citation Index - Science (CPCI-S)
  • Scopus

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