Publications of Raffaello Potestio

Potestio, R.; Fritsch, S.; Espanol, P.; Delgado-Buscalioni, R.; Kremer, K.; Everaers, R.; Donadio, D.: Hamiltonian Adaptive Resolution Simulation for Molecular Liquids. Physical Review Letters 110 (10), 108301 (2013)

Morra, G.; Potestio, R.; Micheletti, C.; Colombo, G.: Corresponding Functional Dynamics across the Hsp90 Chaperone Family: Insights from a Multiscale Analysis of MD Simulations. PLoS Computational Biology 8 (3), e1002433 (2012)

Potestio, R.; Delle Site, L.: Quantum locality and equilibrium properties in low-temperature parahydrogen: A multiscale simulation study. Journal of Chemical Physics 136 (5), 054101 (2012)

Praprotnik, M.; Cortes Huerto, R.; Potestio, R.; Delle Site, L.: Adaptive Resolution Molecular Dynamics Technique. In: Handbook of Materials Modeling, pp. 1 - 15 (Eds. Andreoni, W.; Yip, S.). Springer, Cham (2018)

Fogarty, A. C.; Fiorentini, R.; Kremer, K.; Potestio, R.: Insights into Molecular Recognition: Multi-Resolution Simulations of Proteins and their Hydration Shells to Capture both Global Fluctuations and Chemical Detail. In: NIC Series, Vol. 49, pp. 127 - 135 (Eds. Binder, K.; Müller, M.; Trautmann, A.). NIC Symposium, Jülich, February 22, 2018 - February 23, 2018. John von Neumann Institute for Computing (NIC), Jülich (2018)

Potestio, R.; Fogarty, A.; Peter, C.; Kremer, K.: Adaptive Resolution Simulation. In: Computational Trends in Solvation and Transport in Liquids - Lecture Notes, pp. 353 - 381 (Eds. Sutmann, G.; Grotendorst, J.; Gompper, G.; Marx, D.). CECAM school, 23-27 March 2015, Jülich, Germany, Jülich, March 23, 2015 - March 27, 2015. Forschungszentrum Jülich GmbH, Jülich (2015)

Potestio, R.; Kremer, K.: Theory and Practice of Adaptive Resolution Simulations. In: NIC Series, Vol. 46, pp. 79 - 94 (Eds. Müser, M.; Sutmann, G.; Winkler, R. G.). Hybrid Particle-Continuum Methods in Computational Materials Physics, Jülich, March 04, 2013 - March 07, 2013. John von Neumann Institute for Computing (NIC), Jülich (2013)

Diggins, P. M.; Liu, C. J.; Potestio, R.; Deserno, M.: On the Effect of Mapping in the Coarse Graining of Elastic Networks. In Biophysical Journal, 110 (3), pp. 643A - 643A . Cell Press, Cambridge, Mass. (2016)

Diggins, P. M.; Liu, C. J.; Potestio, R.; Deserno, M.: Investigation of a Method to Efficiently Create Elastic Networks. In Biophysical Journal, 108 (2), 809-Pos, pp. 161A - 161A . Cell Press, Cambridge, Mass. (2015)

Potestio, R.; Fritsch, S.; Espanol, P.; Delgado-Buscalioni, R.; Kremer, K.; Everaers, R.; Donadio, D.: H-AdResS: A Hamiltonian method for adaptive resolution simulations. In Abstracts of Papers of the American Chemical Society, 245, 132-COMP. (2013)