Članki z zahtevami za javni dostop - Christoph DellagoVeč o tem
Ni na voljo nikjer: 11
Library-Based LAMMPS Implementation of High-Dimensional Neural Network Potentials
A Singraber, J Behler, C Dellago
Journal of chemical theory and computation 15 (3), 1827-1840, 2019
Zahteve: Austrian Science Fund, German Research Foundation
Parallel multistream training of high-dimensional neural network potentials
A Singraber, T Morawietz, J Behler, C Dellago
Journal of chemical theory and computation 15 (5), 3075-3092, 2019
Zahteve: Austrian Science Fund, German Research Foundation
Optimising reaction coordinates for crystallisation by tuning the crystallinity definition
S Jungblut, A Singraber, C Dellago
Molecular Physics 111 (22-23), 3527-3533, 2013
Zahteve: Austrian Science Fund
Efficient extraction of free energy profiles from nonequilibrium experiments
H Oberhofer, C Dellago
Journal of computational chemistry 30 (11), 1726-1736, 2009
Zahteve: Austrian Science Fund
Vibrational spectroscopy of water in narrow nanopores
M Weinwurm, C Dellago
The Journal of Physical Chemistry B 115 (18), 5268-5277, 2011
Zahteve: Austrian Science Fund
Design of protein–protein binding sites suggests a rationale for naturally occurring contact areas
F Nerattini, L Tubiana, C Cardelli, V Bianco, C Dellago, I Coluzza
Journal of Chemical Theory and Computation 15 (2), 1383-1392, 2018
Zahteve: Austrian Science Fund
An efficient method to reconstruct free energy profiles for diffusive processes in transition interface sampling and forward flux sampling simulations
L Qin, C Dellago, E Kozeschnik
The Journal of chemical physics 150 (9), 2019
Zahteve: Austrian Science Fund
New methods: general discussion
G Angulo, RD Astumian, V Beniwal, PG Bolhuis, C Dellago, J Ellis, ...
Faraday discussions 195, 521-556, 2016
Zahteve: UK Biotechnology and Biological Sciences Research Council
Dynamical phases of attractive particles sliding on a structured surface
J Hasnain, S Jungblut, C Dellago
Journal of Physics: Condensed Matter 27 (19), 194122, 2015
Zahteve: Austrian Science Fund
Identification of protein functional regions
F Nerattini, M Figliuzzi, C Cardelli, L Tubiana, V Bianco, C Dellago, ...
ChemPhysChem 21 (4), 335-347, 2020
Zahteve: Austrian Science Fund, Government of Spain
A Statistical Methodology to Reconstruct Nucleation Pathways in the Fe-Cu System
L Qin, A Redermeier, E Kozeschnik, C Karner, C Dellago
Materials Science Forum 879, 1529-1534, 2017
Zahteve: Austrian Science Fund
Na voljo nekje: 119
How van der Waals interactions determine the unique properties of water
T Morawietz, A Singraber, C Dellago, J Behler
Proceedings of the National Academy of Sciences 113 (30), 8368-8373, 2016
Zahteve: Austrian Science Fund, German Research Foundation
Direct measurement of photon recoil from a levitated nanoparticle
V Jain, J Gieseler, C Moritz, C Dellago, R Quidant, L Novotny
Physical review letters 116 (24), 243601, 2016
Zahteve: US National Science Foundation, Austrian Science Fund, European Commission
Ab initio thermodynamics of liquid and solid water
B Cheng, EA Engel, J Behler, C Dellago, M Ceriotti
Proceedings of the National Academy of Sciences 116 (4), 1110-1115, 2019
Zahteve: Swiss National Science Foundation, Austrian Science Fund, German Research …
Dynamic relaxation of a levitated nanoparticle from a non-equilibrium steady state
J Gieseler, R Quidant, C Dellago, L Novotny
Nature nanotechnology 9 (5), 358-364, 2014
Zahteve: Austrian Science Fund
Transition path sampling and other advanced simulation techniques for rare events
C Dellago, PG Bolhuis
Advanced computer simulation approaches for soft matter sciences III, 167-233, 2009
Zahteve: Austrian Science Fund
Macroscopically ordered water in nanopores
J Köfinger, G Hummer, C Dellago
Proceedings of the National Academy of Sciences 105 (36), 13218-13222, 2008
Zahteve: US National Institutes of Health, Austrian Science Fund
Direct measurement of Kramers turnover with a levitated nanoparticle
L Rondin, J Gieseler, F Ricci, R Quidant, C Dellago, L Novotny
Nature nanotechnology 12 (12), 1130-1133, 2017
Zahteve: Swiss National Science Foundation, Austrian Science Fund
Molecular mechanism for cavitation in water under tension
G Menzl, MA Gonzalez, P Geiger, F Caupin, JLF Abascal, C Valeriani, ...
Proceedings of the National Academy of Sciences 113 (48), 13582-13587, 2016
Zahteve: Austrian Science Fund, European Commission, Government of Spain
An enhanced version of the heat exchange algorithm with excellent energy conservation properties
P Wirnsberger, D Frenkel, C Dellago
The Journal of chemical physics 143 (12), 2015
Zahteve: Austrian Science Fund, UK Engineering and Physical Sciences Research Council
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