Search Results - "Bruscolini, P"

Ehrenfest Statistical Dynamics in Chemistry: Study of Decoherence Effects by Alonso, J. L., Bruscolini, P., Castro, A., Clemente-Gallardo, J., Cuchí, J. C., Jover-Galtier, J. A.

“…In previous works, we introduced a geometric route to define our Ehrenfest statistical dynamics (ESD) and we proved that, for a simple toy model, the resulting…”
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Comment on "Novel phase behavior in a two-dimensional network-forming lattice fluid" by Bruscolini, P, Pelizzola, A, Casetti, L

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Modeling hydration water and its role in polymer folding by Bruscolini, P, Casetti, L

“…The hydrophobic effect is the dominant force which drives a proteintowards its native state, but its physics has not been thoroughlyunderstood yet. We…”
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Exact solution of the Muñoz-Eaton model for protein folding by Bruscolini, Pierpaolo, Pelizzola, Alessandro

“…A transfer-matrix formalism is introduced to evaluate exactly the partition function of the Muñoz-Eaton model, relating the folding kinetics of proteins of…”
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Model for the hydration of nonpolar compounds and polymers by Bruscolini, P, Casetti, L

“…We introduce an exactly solvable statistical-mechanical model of the hydration of nonpolar compounds, based on grouping water molecules in clusters where…”
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Computational protein design with side-chain conformational entropy by Sciretti, Daniele, Bruscolini, Pierpaolo, Pelizzola, Alessandro, Pretti, Marco, Jaramillo, Alfonso

“…Recent advances in modeling protein structures at the atomic level have made it possible to tackle “de novo” computational protein design. Most procedures are…”
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Bethe approximation for a model of polymer solvation by Bruscolini, P, Buzano, C, Pelizzola, A, Pretti, M

“…The phase diagram of a recently proposed model for the solvation of monomers and polymers in water is studied in the homopolymer case, and several…”
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Lattice model for polymer hydration: collapse of poly(N-isopropylacrylamide) by Bruscolini, Pierpaolo, Buzano, Carla, Pelizzola, Alessandro, Pretti, Marco

“…Poly(N‐isopropylacrylamide) (PNIPAM) in dilute aqueous solution undergoes a collapse transition from coil to globule on increasing temperature. Such…”
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Lattice model for cold and warm swelling of polymers in water by Bruscolini, Pierpaolo, Casetti, Lapo

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Ehrenfest statistical dynamics in chemistry: study of decoherence effects by Alonso, J. L, Bruscolini, P, Castro, A, Clemente-Gallardo, J, Cuchí, J. C, Jover-Galtier, J. A

“…In previous works, we introduced a geometric route to define our Ehrenfest Statistical Dynamics (ESD) and we proved that, for a simple toy-model, the resulting…”
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Downhill versus two-state protein folding in a statistical mechanical model by Bruscolini, P, Pelizzola, A, Zamparo, M

“…J. Chem. Phys. 126, 215103 (2007) The authors address the problem of downhill protein folding in the framework of a simple statistical mechanical model, which…”
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