Publications

2024

• Elter M, Brosz M, Sucerquia D, Kuzhelev A, Kiesewetter DC, Kurth M, Dreuw A, Prisner TF, Freudenberg J, Bunz UHF, Gräter F (2024). Breaking Strong Alkynyl-Phenyl Bonds: Poly(para-phenylene ethynylene)s under Mechanical Stress, Journal of the American Chemical Society 1866
• Boushehri S, Holey H, Brosz M, Gumbsch P, Pastewka L, Aponte-Santamaría C, Gräter F (2024). O-glycans Expand Lubricin and Attenuate Its Viscosity and Shear Thinning, Biomacromolecules,25(7):3893-3908 1865
• Seute L, Hartmann E, Stühmer J, Gräter F (2024). Grappa – A Machine Learned Molecular Mechanics Force Field, In ICML 2024 AI for Science Workshop 1828
• Roessner R, Michelarakis N, Gräter F, Aponte-Santamaría C (2024). Mechanical control of the adhesion of malaria-infected erythrocytes to the placenta, Biophysical Journal,123(3):197a 1787
• Riedmiller K, Reiser P, Bobkova E, Maltsev K, Gryn’ova G, Friederich P, Gräter F (2024). Substituting density functional theory in reaction barrier calculations for hydrogen atom transfer in proteins, Chemical Science 1770
• Richter S, Jin F, Ritterhoff T, Fergin A, Maurer E, Frank A, Hajnal A, Klevit R, Gräter F, Flotho A, Melchior F (2024). SUMO’s intrinsically disordered N-terminus is an intramolecular inhibitor of SUMO – SIM interactions, bioRxiv 1763

2023

• Buhr Sd, Gräter F (2023). Myristoyl’s dual role in allosterically regulating and localizing Abl kinase, eLife 12:e85216. 1556
• Herrera-Rodríguez AM, Dasanna AK, Daday C, Cruz-Chú ER, Aponte-Santamaría C, Schwarz US, Gräter F (2023). The role of flow in the self-assembly of dragline spider silk proteins, Biophysical Journal 1715
• Franz F, Tapia-Rojo R, Winograd-Katz S, Boujemaa-Paterski R, Li W, Unger T, Albeck S, Aponte-Santamaría C, Garcia-Manyes S, Medalia O, Geiger B, Gräter F (2023). Allosteric activation of vinculin by talin, Nat Commun 14, 4311 1505
• Rennekamp B, Karfusehr C, Kurth M, Ünal A, Riedmiller K, Gryn’ova G, Hudson DM, Gräter F (2023). Collagen breaks at weak sacrificial bonds taming its mechanoradicals, Nat Commun 14, 2075 (2023). 1540
• Kutzki F, Butera D, Lay AJ, Maag D, Chiu J, Woon H, Kubař T, Elstner M, Aponte-Santamaría C, Hogg PJ, Gräter F (2023). Disulfide Bond Reduction and Exchange in von-Willebrand-Factor’s C4-Domain Undermines Platelet Binding, Journal of Thrombosis and Haemostasis (2023). 1651
• Dupuy A, Santamaría CA, Yeheskel A, Hortle E, Oehlers SH, Gräter F, Hogg PJ, Passam FH, Chiu J (2023). Mechano-Redox Control of Macrophage-1 Antigen De-Adhesion From ICAM-1 (Intercellular Adhesion Molecule 1) by Protein Disulfide Isomerase Promotes Directional Movement Under Flow, Circulation Research (2023). 1652
• Kurth M, Barayeu U, Gharibi H, Kuzhelev A, Riedmiller K, Zilke J, Noack K, Denysenkov V, Kappl R, Prisner TF, Zubarev RA, Dick TP, Gräter F (2023). DOPA Residues Endow Collagen with Radical Scavenging Capacity, Angew. Chem. Int. Ed. 2023, e202216610 1566
• Diedrich L, Brosz M, Abele T, Steinke S, Gräter F, Göpfrich K, Aponte-Santamaría C (2023). Energetics and kinetics of membrane permeation of photoresists for bioprinting, bioRxiv 1676
• Ehret T, Heißenberg T, Buhr Sd, Aponte-Santamaría C, Steinem C, Gräter F (2023). FERM domains recruit ample PI(4,5)P2s to form extensive protein-membrane attachments, Biophysical Journal 1649
• Buhr J, Franz F, Gräter F (2023). Intrinsically disordered region of talin’s FERM domain functions as an initial PIP2 recognition site, Biophysical Journal 1650

2022

• Treyde AW, Riedmiller K, Gräter F (2022). Bond dissociation energies of X–H bonds in proteins, RSC Advances,12(53):34557-34564 1506
• Chen P, Kutzki F, Mojzisch A, Simon B, Xu E, Aponte-Santamaría C, Horny K, Jeffries C, Schneppenheim R, Wilmanns M, Brehm MA, Gräter F, Hennig J (2022). Structure and dynamics of the von Willebrand Factor C6 domain, Journal of Structural Biology,214(4):107923 1553
• Barayeu U, Schilling D, Eid M, Silva TNXd, Schlicker L, Mitreska N, Zapp C, Gräter F, Miller AK, Kappl R, Schulze A, Angeli JPF, Dick TP (2022). Hydropersulfides inhibit lipid peroxidation and ferroptosis by scavenging radicals, Nature Chemical Biology 19: 28–37 1512
• Gruber S, Löf A, Hausch A, Kutzki F, Jöhr R, Obser T, König G, Schneppenheim R, Aponte-Santamaría C, Gräter F, Brehm MA, Benoit M, Lipfert J (2022). A Conformational Transition of the D’D3 Domain primes von Willebrand Factor for Multimerization, Blood Adv,6(17):5198–5209. 1507
• Brosz M, Michelarakis N, Bunz UHF, Aponte-Santamaría C, Gräter F (2022). Martini 3 coarse-grained force field for poly(para-phenylene ethynylene)s., Physical Chemistry Chemical Physics,24(17):9998-10010 1478
• Dupuy A, Aponte-Santamaría C, Yeheskel A, Gräter F, Hogg PJ, Passam FH, Chiu J (2022). Mechano-redox control of Mac-1 de-adhesion from ICAM-1 by protein disulfide isomerase promotes directional movement of neutrophils under flow, bioRxiv 1509
• Martin I, Nava M, Wickström S, Gräter F (2022). ATP allosterically stabilizes integrin-linked kinase for efficient force generation, PNAS,119 (11) e2106098119 1257
• Gómez-Flores CL, Maag D, Kansari M, Vuong V, Irle S, Gräter F, Kubař T, Elstner M (2022). Accurate Free Energies for Complex Condensed-Phase Reactions Using an Artificial Neural Network Corrected DFTB/MM Methodology., J Chem Theory Comput,18(2):1213-1226. 1454
• Daday C, Buhr Sd, Mercadante D, Gräter F (2022). Mechanical force can enhance c-Src kinase activity by impairing autoinhibition., Biophys J,121(5):684-691 1453
• Martin IM, Aponte-Santamaría C, Schmidt L, Hedtfeld M, Iusupov A, Musacchio A, Gräter F (2022). Phosphorylation tunes elongation propensity and cohesiveness of INCENP’s intrinsically disordered region., J Mol Biol,434(1):167387 1438

2021

• Michelarakis N, Franz F, Gkagkas K, Gräter F (2021). Longitudinal strand ordering leads to shear thinning in Nafion., Physical Chemistry Chemical Physics,23(45):25901-25910 1358
• Banterle N, Nievergelt AP, Buhr Sd, Hatzopoulos GN, Brillard C, Andany S, Hübscher T, Sorgenfrei FA, Schwarz US, Gräter F, Fantner GE, Gönczy P (2021). Kinetic and structural roles for the surface in guiding SAS-6 self-assembly to direct centriole architecture, Nat Commun,12(1):6180. 1360
• Obarska-Kosinska A, Rennekamp B, Ünal A, Gräter F (2021). ColBuilder: A server to build collagen fibril models., Biophysical Journal,120(17):3544-3549 1295
• Jin F, Gräter F (2021). How multisite phosphorylation impacts the conformations of intrinsically disordered proteins., PLoS Computational Biology,17(5):e1008939 1294
• Zha J, Zhang Y, Xia K, Gräter F, Xia F (2021). Coarse-Grained Simulation of Mechanical Properties of Single Microtubules With Micrometer Length., Front Mol Biosci,7:632122. 1293
• Maag D, Putzu M, Gómez-Flores CL, Gräter F, Elstner M, Kubař T (2021). Electrostatic interactions contribute to the control of intramolecular thiol–disulfide isomerization in a protein, Phys Chem Chem Phys,23(46):26366-26375. 1320

2020

• Huck V, Chen P, Xu E, Tischer A, Klemm U, Aponte-Santamaría C, Mess C, Obser T, Kutzki F, König G, Denis CV, Gräter F, Wilmanns M, Auton M, Schneider SW, Schneppenheim R, Hennig J, Brehm MA (2020). Gain-of-Function Variant p.Pro2555Arg of von Willebrand Factor Increases Aggregate Size through Altering Stem Dynamics., Thromb Haemost,122(2):226-239. 1292
• Cruz-Chú ER, Villegas-Rodriguez G, Jäger T, Valentini L, Pugno N, Gkagkas K, Gräter F (2020). Mechanical characterization and induced crystallization in nanocomposites of thermoplastics and carbon nanotubes, Comput Mater,6(1):151 1255
• Acebrón I, Righetto RD, Schoenherr C, Buhr Sd, Redondo P, Culley J, Rodríguez CF, Daday C, Biyani N, Llorca O, Byron A, Chami M, Gräter F, Boskovic J, Frame MC, Stahlberg H, Lietha D (2020). Structural basis of Focal Adhesion Kinase activation on lipid membranes., The EMBO Journal,39(19):e104743 1256
• Zapp C, Obarska-Kosinska A, Rennekamp B, Kurth M, Hudson DM, Mercadante D, Barayeu U, Dick TP, Denysenkov V, Prisner T, Bennati M, Daday C, Kappl R, Gräter F (2020). Mechanoradicals in tensed tendon collagen as a source of oxidative stress, Nat Commun 11(1),2315 1139
• Franz F, Daday C, Gräter F (2020). Advances in molecular simulations of protein mechanical properties and function, Current Opinion in Structural Biology 61:132-138 1095
• Rennekamp B, Kutzki F, Obarska-Kosinska A, Zapp C, Gräter F (2020). Hybrid Kinetic Monte Carlo/Molecular Dynamics Simulations of Bond Scissions in Proteins, J. Chem. Theory Comput. 16(1):553-563 1096

2019

• Suman SK, Daday C, Ferraro T, Vuong-Brender T, Tak S, Quintin S, Robin F, Gräter F, Labouesse M (2019). The plakin domain of C. elegans VAB-10/plectin acts as a hub in a mechanotransduction pathway to promote morphogenesis, Development 146(24):dev183780 1097
• Caetano-Anollés G, Aziz MF, Mughal F, Gräter F, Koç I, Caetano-Anollés K, Caetano-Anollés D (2019). Emergence of Hierarchical Modularity in Evolving Networks Uncovered by Phylogenomic Analysis., Evol Bioinform Online 15:1176934319872980 1120
• Zhang Y, Xia K, Cao Z, Gräter F, Xia F (2019). A new method for the construction of coarse-grained models of large biomolecules from low-resolution cryo-electron microscopy data, Phys. Chem. Chem. Phys. 21(19):9720-9727 1104
• Herrera-Rodríguez AM, Miletić V, Aponte-Santamaría C, Gräter F (2019). Molecular Dynamics Simulations of Molecules in Uniform Flow, Biophysical Journal 116(9):1579-1585 1103
• Sheridan S, Gräter F, Daday C (2019). How Fast Is Too Fast in Force-Probe Molecular Dynamics Simulations?, J. Phys. Chem. B 123(17):3658-3664 1102
• Bauer MS, Baumann F, Daday C, Redondo P, Durner E, Jobst MA, Milles LF, Mercadante D, Pippig DA, Gaub HE, Gräter F, Lietha D (2019). Structural and mechanistic insights into mechanoactivation of focal adhesion kinase, Proc Natl Acad Sci USA 116(14):6766-6774 1101
• Brehm MA, Klemm U, Rehbach C, Erdmann N, Kolšek K, Lin H, Aponte-Santamaría C, Gräter F, Rauch BH, Riley AM, Mayr GW, Potter BV, Windhorst S (2019). Inositol hexakisphosphate increases the size of platelet aggregates, Biochemical Pharmacology 161:14-25 1099
• Daday C, Mateyka LM, Gräter F (2019). How ARVC-Related Mutations Destabilize Desmoplakin: An MD Study, Biophysical Journal 116(5):831-835 1100
• Xu E, Bülow Sv, Chen P, Lenting PJ, Kolšek K, Aponte-Santamaría C, Simon B, Foot J, Obser T, Schneppenheim R, Gräter F, Denis CV, Wilmanns M, Hennig J (2019). Structure and dynamics of the platelet integrin-binding C4 domain of von Willebrand factor, Blood 133(4):366-376 1098
• Gräter F, Li W (2019). Studying Functional Disulphide Bonds by Computer Simulations, Functional Disulphide Bonds 1967:87-113,Springer New York 1105

2018

• Imber M, Huyen NTT, Pietrzyk-Brzezinska AJ, Loi VV, Hillion M, Bernhardt J, Thärichen L, Kolšek K, Saleh M, Hamilton CJ, Adrian L, Gräter F, Wahl MC, Antelmann H (2018). Protein S-Bacillithiolation Functions in Thiol Protection and Redox Regulation of the Glyceraldehyde-3-Phosphate Dehydrogenase Gap in Staphylococcus aureus Under Hypochlorite Stress., Antioxid Redox Signal 20;28(6):410-430 1122
• Butera D, Passam F, Ju L, Cook KM, Woon H, Aponte-Santamaría C, Gardiner E, Davis AK, Murphy DA, Bronowska A, Luken BM, Baldauf C, Jackson S, Andrews R, Gräter F, Hogg PJ (2018). Autoregulation of von Willebrand factor function by a disulfide bond switch, Science Advances, 4(2):eaaq1477 372
• Franz F, Aponte-Santamaría C, Daday C, Miletić V, Gräter F (2018). Stability of Biological Membranes upon Mechanical Indentation, The Journal of Physical Chemistry. B, 122(28):7073–7079 373
• Friedman R, Khalid S, Aponte-Santamaría C, Arutyunova E, Becker M, Boyd KJ, Christensen M, Coimbra JTS, Concilio S, Daday C, Eerden FJv, Fernandes PA, Gräter F, Hakobyan D, Heuer A, Karathanou K, Keller F, Lemieux MJ, Marrink SJ, May ER, Mazumdar A, Naftalin R, Pickholz M, Piotto S, Pohl P, Quinn P, Ramos MJ, Schiøtt B, Sengupta D, Sessa L, Vanni S, Zeppelin T, Zoni V, Bondar A, Domene C (2018). Understanding Conformational Dynamics of Complex Lipid Mixtures Relevant to Biology, The Journal of Membrane Biology, 251(5-6):609–631 374
• Mercadante D, Gräter F, Daday C (2018). CONAN: A Tool to Decode Dynamical Information from Molecular Interaction Maps, Biophysical Journal, 114(6):1267–1273 375
• Passam F, Chiu J, Ju L, Pijning A, Jahan Z, Mor-Cohen R, Yeheskel A, Kolšek K, Thärichen L, Aponte-Santamaría C, Gräter F, Hogg PJ (2018). Mechano-redox control of integrin de-adhesion, eLife, vol. 7 376
• Putzu M, Gräter F, Elstner M, Kubař T (2018). On the mechanism of spontaneous thiol-disulfide exchange in proteins, Physical Chemistry Chemical Physic: PCCP, 20(23):16222–16230 377
• Ray A, Gräter F, Thukral L (2018). Probing molecular forces in multi-component physiological membranes, Physical Chemistry Chemical Physic: PCCP, 20(4):2155–2161 378
• Tan PS, Aramburu IV, Mercadante D, Tyagi S, Chowdhury A, Spitz D, Shammas SL, Gräter F, Lemke EA (2018). Two Differential Binding Mechanisms of FG-Nucleoporins and Nuclear Transport Receptors, Cell Reports, 22(13):3660–3671 379

2017

• Hocq L, Sénéchal F, Lefebvre V, Lehner A, Domon J, Mollet J, Dehors J, Pageau K, Marcelo P, Guérineau F, Kolšek K, Mercadante D, Pelloux J (2017). Combined Experimental and computational approaches reveal distinct pH-dependence of pectin methyl esterase inhibitors, Plant Physiol. 173(2):1075-1093 164
• Cruz-Chú ER, Xiao S, Patil SP, Gkagkas K, Gräter F (2017). Organic Filling Mitigates Flaw-Sensitivity of Nanoscale Aragonite, ACS Biomater. Sci. Eng. 3(3):260-268 162
• Posch S, Aponte-Santamaría C, Schwarzl R, Karner A, Radtke M, Gräter F, Obser T, König G, Brehm MA, Gruber HJ, Netz RR, Baldauf C, Schneppenheim R, Tampé R, Hinterdorfer P (2017). Mutual A domain interactions in the force sensing protein von Willebrand factor, Journal of Structural Biology 197(1):57-64 161
• Mercadante D, Wagner JA, Aramburu IV, Lemke EA, Gräter F (2017). Sampling Long- versus Short-Range Interactions Defines the Ability of Force Fields To Reproduce the Dynamics of Intrinsically Disordered Proteins, Journal of Chemical Theory and Computation, 13:3964–3974 254
• Daday C, Kolšek K, Gräter F (2017). The mechano-sensing role of the unique SH3 insertion in plakin domains revealed by Molecular Dynamics simulations, Scientific Reports, 7:11669 255
• Aponte-Santamaría C, Brunken J, Gräter F (2017). Stress propagation through biological lipid bilayers in silico, JACS Communication, 139:13588–13591 256
• Kolšek K, Aponte-Santamaría C, Gräter F (2017). Accessibility explains preferred thiol-disulfide isomerization in a protein domain., Scientific Reports, 7:9858 257
• Aponte-Santamarı́a C, Fischer G, Båth P, Neutze R, Groot Bd (2017). Temperature dependence of protein-water interactions in a gated yeast aquaporin., Scientific Reports, 7:4016 258
• Briones B, Aponte-Santamarı́a C, Groot Bd (2017). Localization and ordering of lipids around Aquaporin-0: Protein and lipid mobility effects., Frontiers in Physiology, 8:124 259
• Aponte-Santamaría C, Lippok S, Mittag JJ, Obser T, Schneppenheim R, Baldauf C, Gräter F, Budde U, Rädler JO (2017). Mutation G1629E increases von Willebrand factor cleavage via a cooperative destabilization mechanism., Biophysical Journal, 112:57–65 260
• Wagner JA, Patil SP, Greving I, Lämmel M, Gkagkas K, Seydel T, Müller M, Markert B, Gräter F (2017). Stress-induced long-range ordering in spider silk, Scientific Reports, 7:15273 261
• Fuertes G, Banterle N, Ruff KM, Chowdhury A, Mercadante D, Koehler C, Kachala M, Girona GE, Milles S, Mishra A, Onck PR, Gräter F, Esteban-Martín S, Pappu RV, Svergun DI, Lemke EA (2017). Decoupling of size and shape fluctuations in heteropolymeric sequences reconciles discrepancies in SAXS vs. FRET measurements., Proceedings of the National Academy of Sciences of the United States of America, 114:E6342–E6351 262
• Zhou B, Hogg PJ, Gräter F (2017). One-Way Allosteric Communication between the Two Disulfide Bonds in Tissue Factor, Biophysical Journal, 112:78–86 263
• Costescu SSB (2017). Dynamic disorder can explain non-exponential kinetics of fast protein mechanical unfolding, Journal of Structural Biology, 197:43–49 264
• Miletić V, Odorčić I, Nikolić P, Svedružić Ž (2017). In silico design of the first DNA-independent mechanism-based inhibitor of mammalian DNA methyltransferase Dnmt1, PLoS ONE, 12:e0174410 265

2016

• Posch S, Aponte-Santamaría C, Schwarzl R, Karner A, Radtke M, Gräter F, Obser T, König G, Brehm MA, Gruber HJ, Netz RR, Baldauf C, Schneppenheim R, Tampé R, Hinterdorfer P (2016). Single molecule force spectroscopy data and BD- and MD simulations on the blood protein von Willebrand factor., Data Brief 8:1080-7 1121
• Dugard CK, Mertz RA, Rayon C, Mercadante D, Hart C, Benatti MR, Olek AT, SanMiguel PJ, Cooper BR, Reiter W, McCann MC, Carpita NC (2016). The Cell Wall Arabinose-Deficient Arabidopsis thaliana Mutant murus5 Encodes a Defective Allele of REVERSIBLY GLYCOSYLATED POLYPEPTIDE2, Plant Physiol. 171(3):1905-1920 165
• Lippok S, Kolšek K, Löf A, Eggert D, Vanderlinden W, Müller JP, König G, Obser T, Röhrs K, Schneppenheim S, Budde U, Baldauf C, Aponte-Santamaría C, Gräter F, Schneppenheim R, Rädler JO, Brehm MA (2016). von Willebrand factor is dimerized by protein disulfide isomerase, Blood 127(9):1183-1191 160
• Mercadante D, Milles S, Fuertes G, Svergun D, Lemke EA, Gräter F (2016). Rescuing the Over-Collapse of Intrinsically Disordered Proteins using a Force Field Derived by a New Paradigm, Biophysical Journal, 110(3):556a 163
• Aramburu IV, Mercadante D, Milles S, Ringkjøbing M, Banterle N, Koehler C, Tyagi S, Clarke J, Shammas SL, Blackledge M, others (2016). Plasticity of Nucleoporin Nuclear Transport Receptor Interactions-Molecular Description of a Highly Dynamic, Ultrafast Interaction Mechanism, Biophysical Journal, 110(3):357a 166
• Tursch A, Mercadante D, Tennigkeit J, Gräter F, Özbek S (2016). Minicollagen cysteine-rich domains encode distinct modes of polymerization to form stable nematocyst capsules, Scientific Reports, vol. 6 167
• Kent LM, Loo TS, Melton LD, Mercadante D, Williams MA, Jameson GB (2016). Structure and Properties of a Non-processive, Salt-requiring, and Acidophilic Pectin Methylesterase from Aspergillus niger Provide Insights into the Key Determinants of Processivity Control, Journal of Biological Chemistry, 291(3):1289–1306 168

2015

• Gräter F, Li W (2015). Transition Path Sampling with Quantum/Classical Mechanics for Reaction Rates, In Molecular Modeling of Proteins, pp. 27–45, Springer New York 88
• Peralta D, Bronowska AK, Morgan B, Dóka É, Laer KV, Nagy P, Gräter F, Dick TP (2015). A proton relay enhances H2O2 sensitivity of GAPDH to facilitate metabolic adaptation, Nature Chemical Biology, 11(2):156–163 89
• Beckmann A, Xiao S, Müller JP, Mercadante D, Nüchter T, Kröger N, Langhojer F, Petrich W, Holstein TW, Benoit M, others (2015). A fast recoiling silk-like elastomer facilitates nanosecond nematocyst discharge, BMC biology, 13(1):3 90
• Zhou J, Bronowska A, Le Coq J, Lietha D, Gräter F (2015). Allosteric Regulation of Focal Adhesion Kinase by PIP 2 and ATP, Biophysical Journal, 108(3):698–705 91
• Li W, Baldus IB, Gräter F (2015). Redox Potentials of Protein Disulfide Bonds from Free-Energy Calculations, The Journal of Physical Chemistry B, 119(17):5386–5391 92
• Aponte-Santamarı́a C, Huck V, Posch S, Bronowska AK, Graessle S, Brehm MA, Obser T, Schneppenheim R, Hinterdorfer P, Schneider SW, others (2015). Force-Sensitive Autoinhibition of the von Willebrand Factor Is Mediated by Interdomain Interactions, Biophysical journal, 108(9):2312–2321 93
• Mercadante D, Milles S, Fuertes G, Svergun DI, Lemke EA, Gräter F (2015). Kirkwood–Buff approach rescues overcollapse of a disordered protein in canonical protein force fields, The Journal of Physical Chemistry B, 119(25):7975–7984 94
• Wagner JA, Mercadante D, Nikić I, Lemke EA, Gräter F (2015). Origin of Orthogonality of Strain-Promoted Click Reactions, Chemistry–A European Journal, 21(35):12431–12435 95
• Louet M, Seifert C, Hensen U, Gräter F (2015). Dynamic Allostery of the Catabolite Activator Protein Revealed by Interatomic Forces, PLoS Comput Biol, 11(8):e1004358 96
• Milles S, Mercadante D, Aramburu IV, Jensen MR, Banterle N, Köhler C, Tyagi S, Clarke J, Shammas SL, Blackledge M, others (2015). Plasticity of an ultrafast interaction between nucleoporins and nuclear transport receptors, Cell, 163(3):734–745 97
• Zhou J, Aponte-Santamaría C, Sturm S, Bullerjahn JT, Bronowska A, Gräter F (2015). Mechanism of Focal Adhesion Kinase Mechanosensing, PLoS Comput Biol, 11(11):e1004593 98

2014

• Hensen U, Gräter F, Henchman RH (2014). Macromolecular Entropy Can Be Accurately Computed from Force, Journal of Chemical Theory and Computation,10(11):4777-4781 1503