Ab initio simulations of protein-folding pathways by molecular dynamics with the united-residue model of polypeptide chains

Ítems similars

• Molecular Dynamics with the United-Residue (UNRES) Force Field. Ab initio Folding Simulations of Multi-chain Proteins
  per: Rojas, Ana V., et al.
  Publicat: (2007)
• Molecular Dynamics with the United-Residue Model of Polypeptide Chains. II. Langevin and Berendsen-Bath Dynamics and Tests on Model α-Helical Systems
  per: Khalili, Mey, et al.
  Publicat: (2005)
• Molecular Dynamics with the United-Residue Model of Polypeptide Chains. I. Lagrange Equations of Motion and Tests of Numerical Stability in the Microcanonical Mode
  per: Khalili, Mey, et al.
  Publicat: (2005)
• Implementations of Nosé–Hoover and Nosé–Poincaré thermostats in mesoscopic dynamic simulations with the united-residue model of a polypeptide chain
  per: Kleinerman, Dana S., et al.
  Publicat: (2008)
• Determination of effective potentials for the stretching of C(α) ⋯ C(α) virtual bonds in polypeptide chains for coarse-grained simulations of proteins from ab initio energy surfaces of N-methylacetamide and N-acetylpyrrolidine
  per: Sieradzan, Adam K., et al.
  Publicat: (2012)