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A Coarse-Grained Molecular Dynamics Approach to the Study of the Intrinsically Disordered Protein α-Synuclein.

Rafael RamisJoaquín Ortega-CastroRodrigo CasasnovasLaura MariñoBartolomé VilanovaMiquel Angel Mestre AdroverJuan Frau
Published in: J. Chem. Inf. Model. (2019)
Keyphrases
  • coarse grained
  • molecular dynamics
  • fine grained
  • protein sequences
  • protein folding
  • machine learning
  • protein structure
  • amino acids
  • protein structure prediction
  • fluid flow
  • graphical models
  • high performance computing