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Results: 1-15 |
Results: 15
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
Comment on "Efficient stress relaxation in molecular dynamics simulations of semiflexible n-alkanes" - art. no. 028701
Authors: Marchi, M Procacci, P
Citation: M. Marchi et P. Procacci, Comment on "Efficient stress relaxation in molecular dynamics simulations of semiflexible n-alkanes" - art. no. 028701, PHYS REV E, 6302(2), 2001, pp. 8701
Empirical force field for the simulation of a class of chromophores in a photosynthetic center
Authors: Ceccarelli, M Procacci, P Marchi, M
Citation: M. Ceccarelli et al., Empirical force field for the simulation of a class of chromophores in a photosynthetic center, COMP MAT SC, 20(3-4), 2001, pp. 318-324
Interaction between aromatic residues. Molecular dynamics and ab initio exploration of the potential energy surface of the tryptophan-histidine pair
Authors: Gervasio, FL Procacci, P Cardini, G Guarna, A Giolitti, A Schettino, V
Citation: Fl. Gervasio et al., Interaction between aromatic residues. Molecular dynamics and ab initio exploration of the potential energy surface of the tryptophan-histidine pair, J PHYS CH B, 104(5), 2000, pp. 1108-1114
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
Computer-aided series expansion for phonon self-energy
Authors: Della Valle, RG Procacci, P
Citation: Rg. Della Valle et P. Procacci, Computer-aided series expansion for phonon self-energy, J COMPUT PH, 165(2), 2000, pp. 428-436
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
Neurogenic inflammation and muscle pain
Authors: Procacci, P Maresca, M Geppetti, P
Citation: P. Procacci et al., Neurogenic inflammation and muscle pain, J MUSCULO P, 7(1-2), 1999, pp. 5-12
The perikaryal surface of spinal ganglion neurons: differences between domains in contact with satellite cells and in contact with the extracellular matrix
Authors: Pannese, E Procacci, P Berti, E Ledda, M
Citation: E. Pannese et al., The perikaryal surface of spinal ganglion neurons: differences between domains in contact with satellite cells and in contact with the extracellular matrix, ANAT EMBRYO, 199(3), 1999, pp. 199-206
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: 1-15 |