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Volumn 25, Issue , 2014, Pages 722-727

Scaling of the GROMACS 4.6 molecular dynamics code on SuperMUC

Author keywords

benchmark; biomolecular simulation; GROMACS; molecular dynamics; SuperMUC

Indexed keywords


EID: 84902247605     PISSN: 09275452     EISSN: None     Source Type: Book Series    
DOI: 10.3233/978-1-61499-381-0-722     Document Type: Conference Paper
Times cited : (20)

References (10)
  • 1
    • 0035861454 scopus 로고    scopus 로고
    • Water permeation across biological membranes: Mechanism and dynamics of Aquaporin-1 and GlpF
    • B.L. de Groot and H. Grubmüller. Water permeation across biological membranes: mechanism and dynamics of Aquaporin-1 and GlpF. Science, 2001.
    • (2001) Science
    • De Groot, B.L.1    Grubmüller, H.2
  • 7
    • 46249092554 scopus 로고    scopus 로고
    • GROMACS 4: Algorithms for highly efficient, load-balanced, and scalable molecular simulation
    • B. Hess, C. Kutzner, D. van der Spoel, and E. Lindahl. GROMACS 4: Algorithms for highly efficient, load-Balanced, and scalable molecular simulation. J. Chem. Theory Comput., 2008.
    • (2008) J. Chem. Theory Comput.
    • Hess, B.1    Kutzner, C.2    Van Der-Spoel, D.3    Lindahl, E.4
  • 8
    • 84902240419 scopus 로고    scopus 로고
    • Leibniz-Rechenzentrum der Bayerischen Akademie der Wissenschaften. accessed 09-17
    • Leibniz-Rechenzentrum der Bayerischen Akademie der Wissenschaften. SuperMUC system description. http://www.lrz.de, accessed 2013-09-17.
    • (2013) SuperMUC System Description
  • 10
    • 84863989280 scopus 로고    scopus 로고
    • Driving forces and structural determinants of steric zipper peptide oligomer formation elucidated by atomistic simulations
    • D. Matthes and V. Gapsys. Driving Forces and Structural Determinants of Steric Zipper Peptide Oligomer Formation Elucidated by Atomistic Simulations. J. Mol. Biol., 2012.
    • (2012) J. Mol. Biol.
    • Matthes, D.1    Gapsys, V.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.