Autieri, Emmanuel
Autieri, Emmanuel
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Development of Free Energy Calculation Methods for the Study of Monosaccharides Conformation in Computer Simulations
2011-01-01 Autieri, Emmanuel
Dominant reaction pathways in high-dimensional systems
2009-01-01 Autieri, Emmanuel; Faccioli, Pietro; Sega, Marcello; Pederiva, Francesco; H., Orland
On the calculation of puckering free energy surfaces
2009-01-01 Sega, Marcello; Autieri, Emmanuel; Pederiva, Francesco
Pickett angles and Cremer–Pople coordinates as collective variables for the enhanced sampling of six-membered ring conformations
2011-01-01 Sega, M.; Autieri, E.; Pederiva, F.
Puckering free energy of pyranoses: A NMR and metadynamics-umbrella sampling investigation
2010-01-01 Autieri, Emmanuel; M., Sega; Pederiva, Francesco; Guella, Graziano