RNA structural dynamics as captured by molecular simulations: a comprehensive overview J Sponer, G Bussi, M Krepl, P Banáš, S Bottaro, RA Cunha, A Gil-Ley, ... Chemical reviews 118 (8), 4177-4338, 2018 | 442 | 2018 |
Adaptive resolution molecular dynamics simulation through coupling to an internal particle reservoir S Fritsch, S Poblete, C Junghans, G Ciccotti, K Kremer arXiv preprint arXiv:1112.3151, 2011 | 176 | 2011 |
Coupling different levels of resolution in molecular simulations S Poblete, M Praprotnik, K Kremer, L Delle Site The Journal of chemical physics 132 (11), 2010 | 137 | 2010 |
Hydrodynamics of discrete-particle models of spherical colloids: A multiparticle collision dynamics simulation study S Poblete, A Wysocki, G Gompper, RG Winkler Physical Review E 90 (3), 033314, 2014 | 65 | 2014 |
Statistical physics problems in adaptive resolution computer simulations of complex fluids M Praprotnik, S Poblete, K Kremer Journal of Statistical Physics 145, 946-966, 2011 | 43 | 2011 |
Inter-dye distance distributions studied by a combination of single-molecule FRET-filtered lifetime measurements and a weighted accessible volume (wAV) algorithm H Höfig, M Gabba, S Poblete, D Kempe, J Fitter Molecules 19 (12), 19269-19291, 2014 | 39 | 2014 |
A nucleobase-centered coarse-grained representation for structure prediction of RNA motifs S Poblete, S Bottaro, G Bussi Nucleic acids research 46 (4), 1674-1683, 2018 | 38 | 2018 |
Comment on “Adaptive Multiscale Molecular<? format?> Dynamics of Macromolecular Fluids” M Praprotnik, S Poblete, L Delle Site, K Kremer Physical review letters 107 (9), 099801, 2011 | 38 | 2011 |
Conformational state distributions and catalytically relevant dynamics of a hinge-bending enzyme studied by single-molecule FRET and a coarse-grained simulation M Gabba, S Poblete, T Rosenkranz, A Katranidis, D Kempe, T Züchner, ... Biophysical journal 107 (8), 1913-1923, 2014 | 30 | 2014 |
Structure and dynamics of a compact state of a multidomain protein, the mercuric ion reductase L Hong, MA Sharp, S Poblete, R Biehl, M Zamponi, N Szekely, ... Biophysical journal 107 (2), 393-400, 2014 | 30 | 2014 |
A reference implementation of the adaptive resolution scheme in ESPResSo C Junghans, S Poblete Computer Physics Communications 181 (8), 1449-1454, 2010 | 29 | 2010 |
Static and dynamic light scattering by red blood cells: A numerical study J Mauer, M Peltomäki, S Poblete, G Gompper, DA Fedosov PLoS One 12 (5), e0176799, 2017 | 22 | 2017 |
Single-molecule FRET measurements in additive-enriched aqueous solutions D Kempe, M Cerminara, S Poblete, A Schöne, M Gabba, J Fitter Analytical chemistry 89 (1), 694-702, 2017 | 13 | 2017 |
Structural 3d domain reconstruction of the rna genome from viruses with secondary structure models S Poblete, HV Guzman Viruses 13 (8), 1555, 2021 | 12 | 2021 |
Effects and limitations of a nucleobase-driven backmapping procedure for nucleic acids using steered molecular dynamics S Poblete, S Bottaro, G Bussi Biochemical and biophysical research communications 498 (2), 352-358, 2018 | 10 | 2018 |
Rna secondary structures regulate adsorption of fragments onto flat substrates S Poblete, A Bozic, M Kanduc, R Podgornik, HV Guzman ACS omega 6 (48), 32823-32831, 2021 | 7 | 2021 |
Sampling globally and locally correct rna 3d structures using ernwin, spqr and experimental saxs data BC Thiel, G Bussi, S Poblete, IL Hofacker bioRxiv, 2022.07. 02.498583, 2022 | 3 | 2022 |
The G\= oMartini approach: Revisiting the concept of contact maps and the modelling of protein complexes LF Cofas-Vargas, RA Moreira, S Poblete, M Chwastyk, AB Poma arXiv preprint arXiv:2311.08174, 2023 | 2 | 2023 |
Characterization of the melting transition in two dimensions at vanishing external pressure using molecular dynamics simulations D Asenjo, F Lund, S Poblete, R Soto, M Sotomayor Physical Review B 83 (17), 174110, 2011 | 2 | 2011 |
RNA multiscale simulations as an interplay of electrostatic, mechanical properties, and structures inside viruses S Cruz-León, S Assenza, S Poblete, HV Guzman Physical Virology: From the State-of-the-Art Research to the Future of …, 2023 | 1 | 2023 |