| Improved parameters for the Martini coarse-grained protein force field DH de Jong, G Singh, WFD Bennett, C Arnarez, TA Wassenaar, ... Journal of Chemical Theory and Computation 9 (1), 687-697, 2013 | 1498 | 2013 |
| Polarizable water model for the coarse-grained MARTINI force field SO Yesylevskyy, LV Schäfer, D Sengupta, SJ Marrink PLoS Computational Biology 6 (6), e1000810, 2010 | 993 | 2010 |
| Mechanoenzymatics of titin kinase EM Puchner, A Alexandrovich, AL Kho, U Hensen, LV Schäfer, ... Proceedings of the National Academy of Sciences 105 (36), 13385-13390, 2008 | 431 | 2008 |
| Structure and mechanism of the reversible photoswitch of a fluorescent protein M Andresen, MC Wahl, AC Stiel, F Gräter, LV Schäfer, S Trowitzsch, ... Proceedings of the National Academy of Sciences 102 (37), 13070-13074, 2005 | 332 | 2005 |
| Lipid packing drives the segregation of transmembrane helices into disordered lipid domains in model membranes LV Schäfer, DH de Jong, A Holt, AJ Rzepiela, AH de Vries, B Poolman, ... Proceedings of the National Academy of Sciences 108 (4), 1343-1348, 2011 | 276 | 2011 |
| Reconstruction of atomistic details from coarse‐grained structures AJ Rzepiela, LV Schäfer, N Goga, HJ Risselada, AH de Vries, SJ Marrink Journal of Computational Chemistry 31 (6), 1333-1343, 2010 | 229 | 2010 |
| Ultrafast deactivation of an excited cytosine−guanine base pair in DNA G Groenhof, LV Schäfer, M Boggio-Pasqua, M Goette, H Grubmüller, ... Journal of the American Chemical Society 129 (21), 6812-6819, 2007 | 191 | 2007 |
| Mixing MARTINI: electrostatic coupling in hybrid atomistic–coarse-grained biomolecular simulations TA Wassenaar, HI Ingólfsson, M Prieß, SJ Marrink, LV Schäfer The Journal of Physical Chemistry B 117 (13), 3516-3530, 2013 | 180 | 2013 |
| Surface hopping excited-state dynamics study of the photoisomerization of a light-driven fluorene molecular rotary motor A Kazaryan, Z Lan, LV Schäfer, W Thiel, M Filatov Journal of Chemical Theory and Computation 7 (7), 2189-2199, 2011 | 176 | 2011 |
| High-concentration protein formulations: how high is high? P Garidel, AB Kuhn, LV Schäfer, AR Karow-Zwick, M Blech European Journal of Pharmaceutics and Biopharmaceutics 119, 353-360, 2017 | 162 | 2017 |
| Ultrafast deactivation channel for thymine dimerization M Boggio-Pasqua, G Groenhof, LV Schäfer, H Grubmüller, MA Robb Journal of the American Chemical Society 129 (36), 10996-10997, 2007 | 159 | 2007 |
| Photoswitching of the fluorescent protein asFP595: mechanism, proton pathways, and absorption spectra L Schäfer, G Groenhof, AR Klingen, GM Ullmann, M Boggio-Pasqua, ... Angewandte Chemie-International Edition 46 (4), 530-536, 2007 | 144 | 2007 |
| Cholesterol in bilayers with PUFA chains: doping with DMPC or POPC results in sterol reorientation and membrane-domain formation N Kucerka, D Marquardt, TA Harroun, MP Nieh, SR Wassall, DH De Jong, ... Biochemistry 49 (35), 7485-7493, 2010 | 141 | 2010 |
| Transmembrane helices can induce domain formation in crowded model membranes J Domański, SJ Marrink, LV Schäfer Biochimica et Biophysica Acta (BBA)-Biomembranes 1818 (4), 984-994, 2012 | 140 | 2012 |
| Understanding the dynamics behind the photoisomerization of a light-driven fluorene molecular rotary motor A Kazaryan, JCM Kistemaker, LV Schäfer, WR Browne, BL Feringa, ... The Journal of Physical Chemistry A 114 (15), 5058-5067, 2010 | 136 | 2010 |
| Chromophore protonation state controls photoswitching of the fluoroprotein asFP595 LV Schäfer, G Groenhof, M Boggio-Pasqua, MA Robb, H Grubmüller PLoS Computational Biology 4 (3), e1000034, 2008 | 122 | 2008 |
| Influence of hydrophobic mismatch and amino acid composition on the lateral diffusion of transmembrane peptides S Ramadurai, A Holt, LV Schäfer, VV Krasnikov, DTS Rijkers, SJ Marrink, ... Biophysical Journal 99 (5), 1447-1454, 2010 | 106 | 2010 |
| Arginine52 controls the photoisomerization process in photoactive yellow protein G Groenhof, LV Schäfer, M Boggio-Pasqua, H Grubmüller, MA Robb Journal of the American Chemical Society 130 (11), 3250-3251, 2008 | 101 | 2008 |
| Partitioning of lipids at domain boundaries in model membranes LV Schäfer, SJ Marrink Biophysical Journal 99 (12), L91-L93, 2010 | 95 | 2010 |
| Flooding in GROMACS: accelerated barrier crossings in molecular dynamics OF Lange, LV Schäfer, H Grubmüller Journal of Computational Chemistry 27 (14), 1693-1702, 2006 | 92 | 2006 |
Helmut GrubmullerTheoretical and Computational Biophysics Department, Max Planck Institute for MultidisciplinaryVerified email at gwdg.de
