Molecular dynamics simulations of helix bundle proteins using UNRES force field and all-atom force field

K Gao, M Yang - Journal of Theoretical and Computational …, 2012 - World Scientific
We have investigated the folding of two helix-bundle proteins, 36-residue Villin headpiece
and 56-residue E-domain of Staphylococcal protein A, by combining molecular dynamics …

[PDF][PDF] MOLECULAR DYNAMICS SIMULATIONS OF HELIX BUNDLE PROTEINS USING UNRES FORCE FIELD AND ALL-ATOM FORCE FIELD

K GAO, M YANG - Journal of Theoretical and Computational …, 2012 - researchgate.net
We have investigated the folding of two helix-bundle proteins, 36-residue Villin headpiece
and 56-residue E-domain of Staphylococcal protein A, by combining molecular dynamics …