10.6084/m9.figshare.5966884.v1 Deniz Meneksedag Erol Deniz Meneksedag Erol md_NVT.mdp figshare 2018 molecular dynamics simulations Biophysics 2018-03-09 15:40:14 Software https://figshare.com/articles/software/md_NVT_mdp/5966884 Run parameter file for high temperature NVT simulation