Why are MD simulated protein folding times wrong?

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Nerukh, Dmitry;
  • Publisher: Springer
  • Subject:
    arxiv: Quantitative Biology::Biomolecules

The question of significant deviations of protein folding times simulated using molecular dynamics from experimental values is investigated. It is shown that in the framework of Markov State Model (MSM) describing the conformational dynamics of peptides and proteins, th... View more
  • References (19)
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