Machine-guided path sampling to discover mechanisms of molecular self-organization H Jung, R Covino, A Arjun, C Leitold, C Dellago, PG Bolhuis, G Hummer Nature Computational Science 3 (4), 334-345, 2023 | 40 | 2023 |
Folding mechanism of a polymer chain with short-range attractions C Leitold, C Dellago The Journal of Chemical Physics 141 (13), 2014 | 18 | 2014 |
Solvent reaction coordinate for an SN2 reaction C Leitold, CJ Mundy, MD Baer, GK Schenter, B Peters The Journal of Chemical Physics 153 (2), 2020 | 14 | 2020 |
Nucleation and structural growth of cluster crystals C Leitold, C Dellago The Journal of chemical physics 145 (7), 2016 | 9 | 2016 |
A string reaction coordinate for the folding of a polymer chain C Leitold, W Lechner, C Dellago Journal of Physics: Condensed Matter 27 (19), 194126, 2015 | 9 | 2015 |
Solid–solid phase equilibria in the NaCl–KCl system J Anwar, C Leitold, B Peters The Journal of Chemical Physics 152 (14), 2020 | 4 | 2020 |
Artificial intelligence for molecular mechanism discovery H Jung, R Covino, A Arjun, C Leitold, PG Bolhuis, C Dellago, G Hummer Biophysical Journal 122 (3), 281a-282a, 2023 | 1 | 2023 |
The generic unfolding of a biomimetic polymer during force spectroscopy A Chaimovich, C Leitold, C Dellago Soft Matter 16 (16), 3941-3951, 2020 | 1 | 2020 |
Solid–Solid Phase Transitions in the NaCl–KCl System J Anwar, C Leitold, B Peters 2019 AIChE Annual Meeting, 2019 | | 2019 |
Molecular Simulations of a Biomimetic Polymer in Protein Aggregation A Chaimovich, C Leitold, C Dellago 2018 AIChE Annual Meeting, 2018 | | 2018 |
Molecular Simulations of the Force Spectroscopy of a Biomimetic Polymer A Chaimovich, C Leitold, C Dellago 2017 AIChE Annual Meeting, 2017 | | 2017 |
Coil-to-crystal transition of a polymer chain with square-well interactions C Leitold uniwien, 2011 | | 2011 |
Protokoll zum Praktikum Computational Physics: Monte-Carlo-Simulation des 2D One-Component Plasma mit dem Fast-Multipole-Algorithmus C Leitold, P Poier, D Steiner | | 2009 |