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000726344 020__ $$a9783319171487$$qelectronic book
000726344 020__ $$a3319171488$$qelectronic book
000726344 020__ $$z9783319171470
000726344 0247_ $$a10.1007/978-3-319-17148-7$$2doi
000726344 035__ $$aSP(OCoLC)ocn905969534
000726344 035__ $$aSP(OCoLC)905969534
000726344 040__ $$aN$T$$beng$$erda$$epn$$cN$T$$dN$T$$dGW5XE$$dBTCTA$$dE7B$$dUPM$$dDXU$$dCOO$$dYDXCP$$dOCLCF$$dEBLCP$$dVLB
000726344 049__ $$aISEA
000726344 050_4 $$aQP517.M65$$bH45 2015eb
000726344 08204 $$a572.33$$223
000726344 1001_ $$aHeinecke, Alexander,$$eauthor.
000726344 24510 $$aSupercomputing for molecular dynamics simulations$$h[electronic resource] :$$bhandling multi-trillion particles in nanofluidics /$$cAlexander Heinecke, Wolfgang Eckhardt, Martin Horsch, Hans-Joachim Bungartz.
000726344 264_1 $$aCham, Switzerland :$$bSpringer,$$c[2015]
000726344 300__ $$a1 online resource.
000726344 336__ $$atext$$btxt$$2rdacontent
000726344 337__ $$acomputer$$bc$$2rdamedia
000726344 338__ $$aonline resource$$bcr$$2rdacarrier
000726344 4901_ $$aSpringerBriefs in computer science
000726344 504__ $$aIncludes bibliographical references.
000726344 5050_ $$aIntroduction -- Molecular Dynamics Simulation -- Parallelization of MD Algorithms and Load Balancing -- Efficient Implementation of the Force Calculation in MD Simulations -- Experiments -- Conclusion.
000726344 506__ $$aAccess limited to authorized users.
000726344 520__ $$aThis work presents modern implementations of relevant molecular dynamics algorithms using ls1 mardyn, a simulation program for engineering applications. The text focuses strictly on HPC-related aspects, covering implementation on HPC architectures, taking Intel Xeon and Intel Xeon Phi clusters as representatives of current platforms. The work describes distributed and shared-memory parallelization on these platforms, including load balancing, with a particular focus on the efficient implementation of the compute kernels. The text also discusses the software-architecture of the resulting code.
000726344 650_0 $$aMolecular dynamics$$xComputer simulation.
000726344 7001_ $$aEckhardt, Wolfgang,$$eauthor.
000726344 7001_ $$aHorsch, Martin,$$eauthor.
000726344 7001_ $$aBungartz, H.-J.$$q(Hans-Joachim),$$eauthor.
000726344 77608 $$iPrint version:$$z9783319171470
000726344 830_0 $$aSpringerBriefs in computer science.
000726344 852__ $$bebk
000726344 85640 $$3SpringerLink$$uhttps://univsouthin.idm.oclc.org/login?url=http://link.springer.com/10.1007/978-3-319-17148-7$$zOnline Access$$91397441.1
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000726344 980__ $$aEBOOK
000726344 980__ $$aBIB
000726344 982__ $$aEbook
000726344 983__ $$aOnline
000726344 994__ $$a92$$bISE