arXiv-Publications of the Department

June 14, 2019


Most recent Publications



    2019


    1. Hartich D, Godec A. Interlacing relaxation and first-passage phenomena in reversible discrete and continuous space Markovian dynamics. arXiv (submitted on 27 Feb 2018) (preprint) (2019) [pdf] [arXiv]

    2. Kutzner C, Páll S, Fechner M, Esztermann A, de Groot BL, Grubmüller H. More Bang for Your Buck: Improved use of GPU Nodes for GROMACS 2018 arXiv (submitted on 14 Mar 2019) (preprint) (2019) [pdf] [arXiv]


    2018


    1. Nagy G, Hoffmann SV, Jones NC, Grubmüller H. SESCA: Predicting the circular dichroism spectra of proteins from molecular structure. bioRxiv (submitted 9 Mar 2018) (preprint) (2018) [pdf] [bioRxiv]

    2. Rico F, Russek A, Gonzalez L, Grubmuller H, Scheuring S. Heterogeneous and rate-dependent streptavidin-biotin unbinding revealed by high-speed force spectroscopy and molecular dynamics simulations. arXiv (submitted on 21 Aug 2018) (preprint) (2018) [pdf] [arXiv]


    2017


    1. Bock LV, Kolar MH, Grubmüller H. Molecular simulations of the ribosome and associated translation factors. arXiv (submitted on 16 Nov 2017) (preprint) (2017) [pdf] [arXiv]


    2016



      2015


      1. Kutzner C, Páll S, Fechner M, Esztermann A, de Groot B, Grubmüller H. Best bang for your buck: GPU nodes for GROMACS biomolecular simulations. arXiv (submitted on 3 Jul 2015) (preprint) (2015) [pdf] [arXiv]


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