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Fabio Pietrucci
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2020 – today
- 2023
- [i1]Arthur France-Lanord, Hadrien Vroylandt, Mathieu Salanne, Benjamin Rotenberg, A. Marco Saitta, Fabio Pietrucci:
Data-driven path collective variables. CoRR abs/2312.13868 (2023)
2010 – 2019
- 2019
- [j5]Andrea Basciu, Giuliano Malloci, Fabio Pietrucci, Alexandre M. J. J. Bonvin, Attilio Vittorio Vargiu:
Holo-like and Druggable Protein Conformations from Enhanced Sampling of Binding Pocket Volume and Shape. J. Chem. Inf. Model. 59(4): 1515-1528 (2019) - 2012
- [j4]Xevi Biarnés, Fabio Pietrucci, Fabrizio Marinelli, Alessandro Laio:
METAGUI. A VMD interface for analyzing metadynamics and molecular dynamics simulations. Comput. Phys. Commun. 183(1): 203-211 (2012) - 2010
- [j3]Pilar Cossio, Antonio Trovato, Fabio Pietrucci, Flavio Seno, Amos Maritan, Alessandro Laio:
Exploring the Universe of Protein Structures beyond the Protein Data Bank. PLoS Comput. Biol. 6(11) (2010)
2000 – 2009
- 2009
- [j2]Massimiliano Bonomi, Davide Branduardi, Giovanni Bussi, Carlo Camilloni, Davide Provasi, Paolo Raiteri, Davide Donadio, Fabrizio Marinelli, Fabio Pietrucci, Ricardo A. Broglia, Michele Parrinello:
PLUMED: A portable plugin for free-energy calculations with molecular dynamics. Comput. Phys. Commun. 180(10): 1961-1972 (2009) - [j1]Fabrizio Marinelli, Fabio Pietrucci, Alessandro Laio, Stefano Piana:
A Kinetic Model of Trp-Cage Folding from Multiple Biased Molecular Dynamics Simulations. PLoS Comput. Biol. 5(8) (2009)
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