Catalogo dei prodotti della ricerca

CICCOTTI, Giovanni
 Distribuzione geografica
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Continente #
NA - Nord America 7.039
EU - Europa 1.512
AS - Asia 550
SA - Sud America 32
AF - Africa 7
Continente sconosciuto - Info sul continente non disponibili 1
OC - Oceania 1
Totale 9.142
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Nazione #
US - Stati Uniti d'America 7.009
UA - Ucraina 645
IT - Italia 328
IN - India 255
SG - Singapore 193
SE - Svezia 182
FI - Finlandia 165
GB - Regno Unito 101
CN - Cina 87
AR - Argentina 28
CA - Canada 24
DE - Germania 24
IE - Irlanda 20
BE - Belgio 11
RO - Romania 9
RU - Federazione Russa 9
TR - Turchia 9
GR - Grecia 8
MX - Messico 6
CL - Cile 3
IL - Israele 3
NL - Olanda 3
ZA - Sudafrica 3
FR - Francia 2
SK - Slovacchia (Repubblica Slovacca) 2
TG - Togo 2
AU - Australia 1
BD - Bangladesh 1
BG - Bulgaria 1
BR - Brasile 1
EE - Estonia 1
EG - Egitto 1
ES - Italia 1
EU - Europa 1
HK - Hong Kong 1
KZ - Kazakistan 1
SC - Seychelles 1
Totale 9.142
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Città #
Fairfield 1.269
Woodbridge 711
Houston 645
Ashburn 497
Seattle 467
Ann Arbor 404
Chandler 401
Cambridge 378
Wilmington 342
Jacksonville 250
San Paolo di Civitate 230
Princeton 149
Plano 145
Lawrence 130
Millbury 127
Singapore 96
Rome 74
San Diego 70
Beijing 64
Boardman 59
Des Moines 58
Andover 33
Boston 32
Federal 28
Norwalk 28
Falls Church 26
Dearborn 24
Lappeenranta 24
Dublin 20
Toronto 20
Auburn Hills 13
Los Angeles 11
Brussels 10
Indiana 10
Bühl 9
Istanbul 9
Buffalo 7
London 7
New York 7
Philadelphia 7
Redmond 6
Mexico City 5
Southend 5
Tappahannock 5
Yellow Springs 5
Islington 4
San Mateo 4
Würzburg 4
Fort Worth 3
Hefei 3
Kunming 3
Mannheim 3
Pavia 3
Riva 3
San Francisco 3
Trumbull 3
Acton 2
Bratislava 2
Genova 2
Guangzhou 2
Lomé 2
Muizenberg 2
Nanjing 2
Phoenix 2
Seversk 2
Tortoreto 2
Trieste 2
Wuxi 2
Anaheim 1
Arnsberg 1
Baotou 1
Bernareggio 1
Cairo 1
Centro 1
Chula Vista 1
Dhaka 1
Fremont 1
Fuzhou 1
Hanover 1
Hounslow 1
Jinan 1
Kinston 1
Langfang 1
Las Vegas 1
Laurel 1
Le Havre 1
Leawood 1
Madrid 1
Mahé 1
Naaldwijk 1
Nanchang 1
Newport 1
North York 1
Opera 1
Ottawa 1
Paris 1
Prineville 1
Provo 1
Pune 1
Pushkino 1
Totale 7.009
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Nome #
Calculations of free energy barriers for local mechanisms of hydrogen diffusion in alanates 127
Modified single sweep method for reconstructing free-energy landscapes 117
Simulating quantum dynamics in classical environments 112
Bulk viscosity of the Lennard-Jones system at the triple point by dynamical nonequilibrium molecular dynamics 106
Atomic mean-square displacements in proteins by molecular dynamics: A case for analysis of variance 103
On the equivalence of atomic and molecular pressure 99
Trotter-based simulation of quantum-classical dynamics 98
Brownian dynamics with constraints 96
SHEAR-RATE DEPENDENCE OF THE VISCOSITY OF THE LENNARD-JONES LIQUID AT THE TRIPLE POINT 93
Trotter-based simulation of quantum-classical dynamics 93
Effective binding force calculation in a dimeric protein by molecular dynamics simulation 92
Flux expressions and NEMD perturbations for models of semi-flexible molecules 90
Mapping the Network of Pathways of CO Diffusion in Myoglobin 90
Trotter derived algorithms for molecular dynamics with constraints: Velocity Verlet revisited 88
Simulation of a diatomic liquid using hard spheres model 86
Introduction: Condensed matter theory by computer simulation 85
The inelastic hard dimer gas: A nonspherical model for granular matter 84
Compressible convective instability by molecular dynamics 84
Fast simulation of polymer chains 84
An adiabatic linearized path integral approach for quantum time functions: Electronic transport in metal-molten salt solutions 82
Linear and nonlinear viscous flow in two-dimensional fluids 81
Mixed quantum-classical dynamics 81
Lennard-Jones triple-point conductivity via weak external fields: Additional calculations 80
HOOVER NPT DYNAMICS FOR SYSTEMS VARYING IN SHAPE AND SIZE 79
Ab initio simulation of carbon clustering on an Ni(111) surface: A model of the poisoning of nickel-based catalysts 79
QUANTUM EFFECTS ON THE SOLVENT CONTRIBUTION TO THE ACTIVATION FREE-ENERGY 78
Calculations of free energy barriers for local mechanisms of hydrogen diffusion in alanates 78
SHEAR-RATE DEPENDENCE OF THE VISCOSITY OF SIMPLE FLUIDS BY NONEQUILIBRIUM MOLECULAR-DYNAMICS 78
Rare events by constrained molecular dynamics 77
ACTIVATION-ENERGIES BY MOLECULAR-DYNAMICS WITH CONSTRAINTS 77
CONSTRAINED MOLECULAR-DYNAMICS AND THE MEAN POTENTIAL FOR AN ION-PAIR IN A POLAR-SOLVENT 77
THERMAL-CONDUCTIVITY OF THE CLASSICAL ONE-COMPONENT PLASMA BY NONEQUILIBRIUM MOLECULAR-DYNAMICS 77
On the assumptions underlying milestoning 77
Kinetics of phase transitions in two dimensional Ising models studied with the string method 76
The role of loop ZA and Pro371 in the function of yeast Gcn5p bromodomain revealed through molecular dynamics and experiment 76
NONEQUILIBRIUM MOLECULAR-DYNAMICS VIA A NONDIVERGING SUBTRACTION TECHNIQUE 75
2-DIMENSIONAL ORIENTATIONAL MOTION AS A MULTICHANNEL REACTION BY COMPUTER-SIMULATION 75
An adiabatic linearized path integral approach for quantum time-correlation functions II: A cumulant expansion method for improving convergence 75
String method in collective variables: Minimum free energy paths and isocommittor surfaces 75
ACTIVATION FREE-ENERGY FOR PROTON-TRANSFER IN SOLUTION 74
Molecular Dynamics study of surface premelting effects 74
Molecular dynamics of microperoxidases in aqueous and nonaqueous solutions 74
Canonical ensemble and nonequilibrium states by molecular dynamics 74
Blue moon approach to rare events 74
Free energy from constrained molecular dynamics 73
Molecular Dynamics simulation of rigid molecules 72
PARTIAL ENTHALPIES AND RELATED QUANTITIES IN MIXTURES FROM COMPUTER-SIMULATION 72
THERMOTRANSPORT COEFFICIENTS OF A CLASSICAL BINARY IONIC MIXTURE BY NONEQUILIBRIUM MOLECULAR-DYNAMICS 72
Solubility of KF in water by molecular dynamics using the Kirkwood integration method 72
Relaxation of a steep density gradient in a simple fluid: Comparison between atomistic and continuum modeling 72
Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems 71
CONSTRAINED REACTION COORDINATE DYNAMICS FOR THE SIMULATION OF RARE EVENTS 71
Deterministic and stochastic algorithms for mechanical systems under constraints 71
SAMPLING OF MOLECULAR-CONFORMATIONS BY MOLECULAR-DYNAMICS TECHNIQUES 70
On the properties of a bundle of flexible actin filaments in an optical trap 70
The semiclassical limit of the intermediate scattering function 69
Mapping the hydropathy of amino acids based on their local solvation structure 69
THERMAL RELAXATION OF SUPERCRITICAL FLUIDS BY EQUILIBRIUM MOLECULAR-DYNAMICS 68
Adaptive resolution molecular dynamics simulation through coupling to an internal particle reservoir 68
Silver self aggregation in a nanodevice for enhanced Raman spectroscopy: Experiments vs. simplified modeling via molecular dynamics 68
Surface-hopping dynamics of a spin-boson system 68
Atomic stress isobaric scaling for systems subjected to holonomic constraints 67
Blue moon sampling, vectorial reaction coordinates, and unbiased constrained dynamics 66
Intrinsic frame transport for a model of nematic liquid crystal 66
MOLECULAR-DYNAMICS SIMULATION OF ELECTRON-TRANSFER REACTIONS IN SOLUTION 66
Combining Rare Events Techniques: Phase Change in Si Nanoparticles 66
Statistical mechanics of quantum-classical systems 66
Molecular dynamics study of solvation effects on acid dissociation in aprotic media 65
Communications: On the linear response of mechanical systems with constraints 63
MOLECULAR-DYNAMICS STUDY OF THE ATOMIC DIFFUSION IN GLASSES INDUCED BY AN EXTERNAL PERTURBATION 63
THERMAL-CONDUCTIVITY OF THE LENNARD-JONES LIQUID BY MOLECULAR-DYNAMICS CALCULATIONS 62
Quantum statistical dynamics with trajectories 62
Dense-fluid trasport coefficients via constrained substraction technique 61
Sequential short-time propagation of quantum-classical dynamics 61
Short range hydrogen diffusion in Na3AlH6 60
Hydrodynamics from dynamical non-equilibrium MD 60
Hydrodynamics from statistical mechanics: combined dynamical-NEMD and conditional sampling to relax an interface between two immiscible liquids 60
Protein-trehalose-water structures in trehalose coated carboxy-myoglobin 59
Linearization approximations and Liouville quantum-classical dynamics 59
Theory and methods for rare events 59
Constrained reaction coordinate dynamics for systems with constraints 59
Second-order integrators for Langevin equations with holonomic constraints 59
Mixed quantum-classical surface hopping dynamics 59
Molecular dynamics simulation of carboxy-myoglobin embedded in a trehalose-water matrix 59
COMPUTATION OF PARTIAL ENTHALPIES OF VARIOUS LENNARD-JONES MODEL MIXTURES BY NPT MOLECULAR-DYNAMICS 59
Wigner approach to the semiclassical dynamics of a quantum many-body system: the dynamic scattering function of He-4 59
Transient hydrodynamical behavior by dynamical nonequilibrium molecular dynamics: The formation of convective cells 59
Path integral based calculations of symmetrized time correlation functions. I. 58
Infrared spectroscopy and effective modes analysis of the protonated water dimer H+(H2O)2 at room temperature under H/D substitution 57
Computing the acidity of liquids via ab initio molecular dynamics 56
Mechanisms and Nucleation Rate of Methane Hydrate by Dynamical Nonequilibrium Molecular Dynamics 56
SIMULATION OF SITE SITE SOFT-CORE LIQUID-CRYSTAL MODELS 55
An observable for vacancy characterization and diffusion in crystals 55
DYNAMICS OF ION-PAIR INTERCONVERSION IN A POLAR-SOLVENT 55
Molecular dynamics simulation of sucrose- and trehalose-coated carboxy-myoglobin 55
Coarse-graining stiff bonds 54
Free energies for rare events: temperature accelerated MD and MC 54
Soret coefficient of isotopic lennard-Jones mixtures and the Ar-Kr system as determinad by equilibrium molecular dynamics 53
Simulating reactions that occur once in a blue moon 53
Do we have a consistent non-adiabatic quantum-classical statistical mechanics? 53
Totale 7.264
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Categoria #
all - tutte 22.365
article - articoli 0
book - libri 0
conference - conferenze 0
curatela - curatele 0
other - altro 0
patent - brevetti 0
selected - selezionate 0
volume - volumi 0
Totale 22.365
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/20202.484 351 119 31 171 246 306 290 334 268 201 101 66
2020/2021848 155 153 29 79 6 84 15 76 68 109 59 15
2021/20221.470 7 106 152 35 194 56 42 178 93 125 172 310
2022/20231.514 258 433 69 142 184 174 0 69 127 2 43 13
2023/2024367 35 82 8 24 16 4 7 8 0 81 37 65
2024/202567 67 0 0 0 0 0 0 0 0 0 0 0
Totale 9.198