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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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Datu multzoak
222

Erakundeak

  • Molecular Dynamics Group - 222

Collections

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Etiketak

  • barostat is Berendsen - 222
  • GROMOS - 222
  • No. atoms at least 10000 - 222
  • solvent-H2O - 222
  • thermostat is Berendsen - 222
  • Temperature 290-300 - 220
  • Box size at least 10 - 219
  • replicate-1 of 3 - 215
  • 54A7 - 198
  • protein - 195

Erakutsi gehiago Etiketak

Formatuak

  • in - 222
  • log - 222
  • mden - 222
  • nc - 222 x
  • pdb - 222
  • prmtop - 222
  • inpcrd - 221

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222 datu multzo aurkituta

Formatuak: nc

Emaitzak iragazi

  • Alpha-helical peptide AP

    Alpha-helical peptide AP with GROMOS 54A7 in AMBER (replicate 2 of 3).
    • in
    • mden
    • inpcrd
    • log
    • pdb
    • prmtop
    • nc

  • Alpha-helical peptide AP

    Alpha-helical peptide AP with GROMOS 54A7 in AMBER (replicate 1 of 3).
    • 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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