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mduq

Molecular Dynamics Group

The group focuses on understanding and predicting the macroscopic (experimentally observable) properties of biomolecular systems such as proteins, nucleic acids and lipid...

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  • Molecular Dynamics Group - 1

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Cimkék

  • 54A7 - 1
  • barostat is Berendsen - 1
  • Box size at least 10 - 1
  • GROMOS - 1
  • No. atoms at least 10000 - 1
  • peptide - 1
  • peptide-alpha-helic... - 1
  • replicate-1 of 1 - 1
  • Simulation time at... - 1
  • solvent-H2O - 1

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Formátumok

  • in - 1
  • inpcrd - 1
  • log - 1
  • mden - 1
  • nc - 1
  • pdb - 1
  • prmtop - 1

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1 dataset found

Cimkék: Temperature 280-290

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  • Alpha-helical peptide YGA

    Alpha-helical peptide YGA with GROMOS 54A7 in AMBER (replicate 1 of 1).
    • in
    • mden
    • inpcrd
    • log
    • pdb
    • prmtop
    • nc
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ARDC

The Australasian Computational and Simulation Commons project received investment from the NCRIS-enabled ARDC infrastructure under investment identifier 10.47486/DP723

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