| Markov models of molecular kinetics: Generation and validation JH Prinz, H Wu, M Sarich, B Keller, M Senne, M Held, JD Chodera, ... The Journal of chemical physics 134 (17), 2011 | 1305 | 2011 |
| Constructing the equilibrium ensemble of folding pathways from short off-equilibrium simulations F Noé, C Schütte, E Vanden-Eijnden, L Reich, TR Weikl Proceedings of the National Academy of Sciences 106 (45), 19011-19016, 2009 | 903 | 2009 |
| Unwinding of a skyrmion lattice by magnetic monopoles P Milde, D Köhler, J Seidel, LM Eng, A Bauer, A Chacon, J Kindervater, ... Science 340 (6136), 1076-1080, 2013 | 653 | 2013 |
| Transition path theory for Markov jump processes P Metzner, C Schütte, E Vanden-Eijnden Multiscale Modeling & Simulation 7 (3), 1192-1219, 2009 | 518 | 2009 |
| Hierarchical analysis of conformational dynamics in biomolecules: Transition networks of metastable states F Noé, I Horenko, C Schütte, JC Smith The Journal of chemical physics 126 (15), 2007 | 471 | 2007 |
| On the numerical approximation of the Perron-Frobenius and Koopman operator S Klus, P Koltai, C Schütte arXiv preprint arXiv:1512.05997, 2015 | 339 | 2015 |
| A variational approach to modeling slow processes in stochastic dynamical systems F Noé, F Nuske Multiscale Modeling & Simulation 11 (2), 635-655, 2013 | 337 | 2013 |
| Data-driven model reduction and transfer operator approximation S Klus, F Nüske, P Koltai, H Wu, I Kevrekidis, C Schütte, F Noé Journal of Nonlinear Science 28, 985-1010, 2018 | 303 | 2018 |
| Markov state models based on milestoning C Schütte, F Noé, J Lu, M Sarich, E Vanden-Eijnden The Journal of chemical physics 134 (20), 2011 | 274 | 2011 |
| Data-driven approximation of the Koopman generator: Model reduction, system identification, and control S Klus, F Nüske, S Peitz, JH Niemann, C Clementi, C Schütte Physica D: Nonlinear Phenomena 406, 132416, 2020 | 240 | 2020 |
| Illustration of transition path theory on a collection of simple examples P Metzner, C Schütte, E Vanden-Eijnden The Journal of chemical physics 125 (8), 2006 | 240 | 2006 |
| On the approximation quality of Markov state models M Sarich, F Noé, C Schütte Multiscale Modeling & Simulation 8 (4), 1154-1177, 2010 | 220 | 2010 |
| Quantum-classical Liouville approach to molecular dynamics: Surface hopping Gaussian phase-space packets I Horenko, C Salzmann, B Schmidt, C Schütte The Journal of chemical physics 117 (24), 11075-11088, 2002 | 175 | 2002 |
| Conformational dynamics: modelling, theory, algorithm, and application to biomolecules C Schütte | 174 | 1999 |
| Metastability and markov state models in molecular dynamics C Schütte, M Sarich American Mathematical Soc., 2013 | 165 | 2013 |
| Quantum‐classical molecular dynamics as an approximation to full quantum dynamics FA Bornemann, P Nettesheim, C Schütte The Journal of chemical physics 105 (3), 1074-1083, 1996 | 165 | 1996 |
| Phase transitions and metastability in Markovian and molecular systems W Huisinga, S Meyn, C Schütte The Annals of Applied Probability 14 (1), 419-458, 2004 | 137 | 2004 |
| Grand-Canonical-like Molecular-Dynamics Simulations by Using<? format?> an Adaptive-Resolution Technique H Wang, C Hartmann, C Schütte, L Delle Site Physical Review X 3 (1), 011018, 2013 | 119 | 2013 |
| Single-molecule analysis reveals agonist-specific dimer formation of µ-opioid receptors J Möller, A Isbilir, T Sungkaworn, B Osberg, C Karathanasis, V Sunkara, ... Nature Chemical Biology 16 (9), 946-954, 2020 | 115 | 2020 |
| Biomolecular conformations can be identified as metastable sets of molecular dynamics C Schütte, W Huisinga Handbook of numerical analysis 10, 699-744, 2003 | 114 | 2003 |
