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Science / Molecular modelling / Parallel computing / Intermolecular forces / Molecular physics / LAMMPS / Molecular dynamics / Blue Gene / NAMD / Chemistry / Computing / Computational chemistry


Bioinformatics Applications on Blue Gene Platforms:
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Document Date: 2012-11-21 10:26:11


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Company

Sandia National Laboratories / Life Sciences / International Business Machines Corporation / IBM Corporation / Aon / J. Comp / /

Country

United States / /

Facility

Howard Hughes Medical Institute / Yale University / Scripps Research Institute / /

IndustryTerm

micro-processors / parallel algorithms / energy equation / molecular dynamics applications / granular systems / large biological molecular systems / parallel processing / parallel systems / software packages / open-source software / computational chemistry applications / larger systems / /

OperatingSystem

GNU / /

Organization

Department of Molecular Biophysics and Biochemistry / Scripps Research Institute / Howard Hughes Medical Institute / Yale University / /

Person

AMBER PME / Zheng Milledge / Blue Gene / B. D. Olafson / AMBER GB / Tom Milledge / Jeffrey McAllister / /

Position

model / /

ProgrammingLanguage

C++ / /

PublishedMedium

Journal of Computational Chemistry / /

Technology

parallel algorithms / ethernet / RAM / 500 0 0 512 1024 1536 2048 2560 3072 Processors / X-ray / computational chemistry / system-on-a-chip / massively parallel processing / 1536 1024 512 0 0 512 1024 Processors / 300 200 100 0 0 128 256 384 512 Processors / 5.6 Gigaflops/chip / simulation / PME algorithm / html / 8192 processors / 3000 2000 1000 0 0 2000 4000 6000 8000 Processors / /

URL

http /

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