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Results: 1-11 |
Results: 11
Determination of the potential of mean force of aromatic amino acid complexes in various solvents using molecular dynamics simulations: The case of the tryptophan-histidine pair
Authors: Gervasio, FL Chelli, R Marchi, M Procacci, P Schettino, V
Citation: Fl. Gervasio et al., Determination of the potential of mean force of aromatic amino acid complexes in various solvents using molecular dynamics simulations: The case of the tryptophan-histidine pair, J PHYS CH B, 105(32), 2001, pp. 7835-7846
The fast dynamics of benzene in the liquid phase - Part I. Optical Kerr effect experimental investigation
Authors: Ricci, M Bartolini, P Chelli, R Cardini, G Califano, S Righini, R
Citation: M. Ricci et al., The fast dynamics of benzene in the liquid phase - Part I. Optical Kerr effect experimental investigation, PHYS CHEM P, 3(14), 2001, pp. 2795-2802
The fast dynamics of benzene in the liquid phase - Part II. A molecular dynamics simulation
Authors: Chelli, R Cardini, G Ricci, M Bartolini, P Righini, R Califano, S
Citation: R. Chelli et al., The fast dynamics of benzene in the liquid phase - Part II. A molecular dynamics simulation, PHYS CHEM P, 3(14), 2001, pp. 2803-2810
Conformational distribution of gas-phase glycerol
Authors: Chelli, R Gervasio, FL Gellini, C Procacci, P Cardini, G Schettino, V
Citation: R. Chelli et al., Conformational distribution of gas-phase glycerol, J PHYS CH A, 104(47), 2000, pp. 11220-11222
Density functional calculation of structural and vibrational properties ofglycerol
Authors: Chelli, R Gervasio, FL Gellini, C Procacci, P Cardini, G Schettino, V
Citation: R. Chelli et al., Density functional calculation of structural and vibrational properties ofglycerol, J PHYS CH A, 104(22), 2000, pp. 5351-5357
Simulated structure, dynamics, and vibrational spectra of liquid benzene
Authors: Chelli, R Cardini, G Procacci, P Righini, R Califano, S Albrecht, A
Citation: R. Chelli et al., Simulated structure, dynamics, and vibrational spectra of liquid benzene, J CHEM PHYS, 113(16), 2000, pp. 6851-6863
Calculation of optical spectra in liquid methanol using molecular dynamicsand the chemical potential equalization method (vol 111, pg 4218, 1999)
Authors: Chelli, R Ciabatti, S Cardini, G Righini, R Procacci, P
Citation: R. Chelli et al., Calculation of optical spectra in liquid methanol using molecular dynamicsand the chemical potential equalization method (vol 111, pg 4218, 1999), J CHEM PHYS, 112(12), 2000, pp. 5515-5515
Glycerol condensed phases Part I. A molecular dynamics study
Authors: Chelli, R Procacci, P Cardini, G Della Valle, RG Califano, S
Citation: R. Chelli et al., Glycerol condensed phases Part I. A molecular dynamics study, PCCP PHYS C, 1(5), 1999, pp. 871-877
Glycerol condensed phases part II. A molecular dynamics study of the conformational structure and hydrogen bonding
Authors: Chelli, R Procacci, P Cardini, G Califano, S
Citation: R. Chelli et al., Glycerol condensed phases part II. A molecular dynamics study of the conformational structure and hydrogen bonding, PCCP PHYS C, 1(5), 1999, pp. 879-885
Calculation of optical spectra in liquid methanol using molecular dynamicsand the chemical potential equalization method
Authors: Chelli, R Ciabatti, S Cardini, G Righini, R Procacci, P
Citation: R. Chelli et al., Calculation of optical spectra in liquid methanol using molecular dynamicsand the chemical potential equalization method, J CHEM PHYS, 111(9), 1999, pp. 4218-4229
Electrical response in chemical potential equalization schemes
Authors: Chelli, R Procacci, P Righini, R Califano, S
Citation: R. Chelli et al., Electrical response in chemical potential equalization schemes, J CHEM PHYS, 111(18), 1999, pp. 8569-8575
Risultati: 1-11 |