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Results: 1-12 |
Results: 12
Constrained isothermal-isobaric molecular dynamics with full atomic virial
Authors: Ciccotti, G Martyna, GJ Melchionna, S Tuckerman, ME
Citation: G. Ciccotti et al., Constrained isothermal-isobaric molecular dynamics with full atomic virial, J PHYS CH B, 105(28), 2001, pp. 6710-6715
Brownian dynamics with constraints
Authors: White, TO Ciccotti, G Hansen, JP
Citation: To. White et al., Brownian dynamics with constraints, MOLEC PHYS, 99(24), 2001, pp. 2023-2036
Flux expressions and NEMD perturbations for models of semi-flexible molecules
Authors: Perronace, A Simon, JM Rousseau, B Ciccotti, G
Citation: A. Perronace et al., Flux expressions and NEMD perturbations for models of semi-flexible molecules, MOLEC PHYS, 99(13), 2001, pp. 1139-1149
Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems
Authors: Tuckerman, ME Liu, Y Ciccotti, G Martyna, GJ
Citation: Me. Tuckerman et al., Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems, J CHEM PHYS, 115(4), 2001, pp. 1678-1702
Statistical mechanics of quantum-classical systems
Authors: Nielsen, S Kapral, R Ciccotti, G
Citation: S. Nielsen et al., Statistical mechanics of quantum-classical systems, J CHEM PHYS, 115(13), 2001, pp. 5805-5815
Molecular dynamics simulation of carboxy-myoglobin embedded in a trehalose-water matrix
Authors: Cottone, G Cordone, L Ciccotti, G
Citation: G. Cottone et al., Molecular dynamics simulation of carboxy-myoglobin embedded in a trehalose-water matrix, BIOPHYS J, 80(2), 2001, pp. 931-938
Hydration of beta-cyclodextrin: A molecular dynamics simulation study
Authors: Winkler, RG Fioravanti, S Ciccotti, G Margheritis, C Villa, M
Citation: Rg. Winkler et al., Hydration of beta-cyclodextrin: A molecular dynamics simulation study, J COMPUT A, 14(7), 2000, pp. 659-667
Rare events by constrained molecular dynamics
Authors: Ciccotti, G Ferrario, M
Citation: G. Ciccotti et M. Ferrario, Rare events by constrained molecular dynamics, J MOL LIQ, 89(1-3), 2000, pp. 1-18
Non-adiabatic dynamics in mixed quantum-classical systems
Authors: Nielsen, S Kapral, R Ciccotti, G
Citation: S. Nielsen et al., Non-adiabatic dynamics in mixed quantum-classical systems, J STAT PHYS, 101(1-2), 2000, pp. 225-242
Mixed quantum-classical surface hopping dynamics
Authors: Nielsen, S Kapral, R Ciccotti, G
Citation: S. Nielsen et al., Mixed quantum-classical surface hopping dynamics, J CHEM PHYS, 112(15), 2000, pp. 6543-6553
Mixed quantum-classical dynamics
Authors: Kapral, R Ciccotti, G
Citation: R. Kapral et G. Ciccotti, Mixed quantum-classical dynamics, J CHEM PHYS, 110(18), 1999, pp. 8919-8929
Wigner approach to the semiclassical dynamics of a quantum many-body system: the dynamic scattering function of He-4
Authors: Ciccotti, G Pierleoni, C Capuani, F Filinov, VS
Citation: G. Ciccotti et al., Wigner approach to the semiclassical dynamics of a quantum many-body system: the dynamic scattering function of He-4, COMP PHYS C, 122, 1999, pp. 452-459
Risultati: 1-12 |