CHELLI, RICCARDO
 Distribuzione geografica
Salva come PNG Salva come JPEG
Continente #
NA - Nord America 10.427
EU - Europa 4.427
AS - Asia 2.868
SA - Sud America 407
AF - Africa 74
OC - Oceania 68
Continente sconosciuto - Info sul continente non disponibili 9
Totale 18.280
Salva come PNG Salva come JPEG
Nazione #
US - Stati Uniti d'America 10.350
RU - Federazione Russa 1.582
SG - Singapore 854
PL - Polonia 843
CN - Cina 604
HK - Hong Kong 486
SE - Svezia 475
IE - Irlanda 409
IT - Italia 365
VN - Vietnam 346
BR - Brasile 310
KR - Corea 238
DE - Germania 175
FI - Finlandia 124
FR - Francia 122
UA - Ucraina 97
GB - Regno Unito 88
IN - India 81
TR - Turchia 68
AU - Australia 67
AR - Argentina 46
CA - Canada 43
ID - Indonesia 28
IQ - Iraq 28
CH - Svizzera 24
ES - Italia 23
NL - Olanda 23
AT - Austria 21
CI - Costa d'Avorio 21
JP - Giappone 20
MX - Messico 19
BD - Bangladesh 18
BE - Belgio 18
JO - Giordania 16
PK - Pakistan 15
EC - Ecuador 13
VE - Venezuela 12
ZA - Sudafrica 11
CO - Colombia 10
PT - Portogallo 10
EU - Europa 9
PH - Filippine 8
SC - Seychelles 8
AE - Emirati Arabi Uniti 7
CL - Cile 7
KE - Kenya 7
LT - Lituania 6
NG - Nigeria 6
SA - Arabia Saudita 6
UZ - Uzbekistan 6
MA - Marocco 5
MY - Malesia 5
BH - Bahrain 4
IR - Iran 4
JM - Giamaica 4
BO - Bolivia 3
ET - Etiopia 3
MD - Moldavia 3
NP - Nepal 3
PE - Perù 3
RS - Serbia 3
SN - Senegal 3
TN - Tunisia 3
AZ - Azerbaigian 2
CR - Costa Rica 2
CZ - Repubblica Ceca 2
DO - Repubblica Dominicana 2
EG - Egitto 2
GR - Grecia 2
KG - Kirghizistan 2
KZ - Kazakistan 2
LB - Libano 2
LK - Sri Lanka 2
LV - Lettonia 2
QA - Qatar 2
RO - Romania 2
TT - Trinidad e Tobago 2
TW - Taiwan 2
UY - Uruguay 2
AF - Afghanistan, Repubblica islamica di 1
AO - Angola 1
BG - Bulgaria 1
BY - Bielorussia 1
CM - Camerun 1
CU - Cuba 1
DZ - Algeria 1
EE - Estonia 1
GA - Gabon 1
GE - Georgia 1
GT - Guatemala 1
GY - Guiana 1
HN - Honduras 1
HR - Croazia 1
HU - Ungheria 1
IL - Israele 1
IS - Islanda 1
KW - Kuwait 1
LY - Libia 1
NZ - Nuova Zelanda 1
OM - Oman 1
Totale 18.272
Salva come PNG Salva come JPEG
Città #
Santa Clara 1.896
Fairfield 1.436
Ashburn 1.111
Warsaw 841
Woodbridge 661
Seattle 621
Singapore 611
Houston 537
Cambridge 533
Chandler 435
Wilmington 418
Dublin 409
Hong Kong 398
Seoul 237
Ann Arbor 226
Jacksonville 213
San Jose 197
Beijing 152
Lawrence 133
Princeton 117
Florence 109
The Dalles 108
Altamura 101
Ho Chi Minh City 98
Lauterbourg 93
Hanoi 88
Hefei 84
Boardman 80
Medford 77
Los Angeles 75
Buffalo 64
Melbourne 64
Moscow 64
Izmir 54
Boston 50
Dallas 46
Mumbai 46
San Diego 43
São Paulo 42
Munich 36
New York 33
Shanghai 33
Kent 28
Orem 25
Norwalk 24
Bern 23
Clifton 22
Abidjan 21
Vienna 21
Council Bluffs 19
Tokyo 19
Andover 18
Brussels 18
Toronto 18
London 17
Da Nang 16
Chicago 15
Falls Church 15
Helsinki 15
Jakarta 15
Bologna 14
Haiphong 13
Montreal 13
Paris 13
Dong Ket 12
Frankfurt am Main 12
Hillsboro 12
Turku 12
Phoenix 11
Redondo Beach 10
Rio de Janeiro 10
Barcelona 9
Brooklyn 9
Guangzhou 9
Ninh Bình 8
Yubileyny 8
Buenos Aires 7
Stockholm 7
Tappahannock 7
Amsterdam 6
Baghdad 6
Curitiba 6
Dhaka 6
Milan 6
San Francisco 6
Scuola 6
Shenzhen 6
Tashkent 6
Tianjin 6
Biên Hòa 5
Brasília 5
Can Tho 5
Chennai 5
Guayaquil 5
Hải Dương 5
Islamabad 5
Manaus 5
Nairobi 5
Redwood City 5
Abuja 4
Totale 13.329
Salva come PNG Salva come JPEG
Nome #
Implementations of nonequilibrium methods for free energy calculations: forthcoming developments of the ORAC molecular dynamics simulation code 285
Electrostatic interactions in phospholipid membranes revealed by coherent 2D IR spectroscopy 278
About a world where second law of thermodynamics can be violated 278
Calculation of optical spectra in liquid methanol using molecular dynamics and the chemical potential equalization method 274
Statistical Mechanics of Ligand-Receptor Noncovalent Association, Revisited: Binding Site and Standard State Volumes in Modern Alchemical Theories 273
Photochemical reactivity of 1,6-methano[10]annulene 255
Convective replica-exchange in ergodic regimes 242
A study on the anisole-water complex by molecular beam-electronic spectroscopy and molecular mechanics calculations 240
Behavior of polarizable models in presence of strong electric fields. I. Origin of nonlinear effects in water point-charge systems 230
Insights on the Realgar Crystal Under Pressure from XP-PCM and Periodic Model Calculations 226
Combining path-breaking with bidirectional nonequilibrium simulations to improve efficiency in free energy calculations 223
A fluorescent receptor for halide recognition: clues for the design of anion chemosensors 223
Binding Free Energies of Host-Guest Systems by Nonequilibrium Alchemical Simulations with Constrained Dynamics: Theoretical Framework 216
Structural insights into the osteopontin-aptamer complex by molecular dynamics simulations 214
A photochromic azobenzene peptidomimetic of a β-turn model peptide structure as a conformational switch 211
Annealed importance sampling with constant cooling rate 209
Two-dimensional infrared spectroscopy of a structured liquid: Neat formamide 208
A transferable polarizable electrostatic force field for molecular mechanics based on the chemical potential equalization principle 206
Polyamine-polycarboxylate metal complexes with different biological effectiveness as nitric oxide scavengers. Clues for drug design 206
Electrical response in chemical potential equalization schemes 206
Imidazole in Aqueous Solution: Hydrogen Bond Interactions and Structural Reorganization with Concentration 203
Exploiting configurational freezing in nonequilibrium Monte Carlo simulations 202
A molecular dynamics study of translational-rotation coupling in the NaCN plastic cystal 198
Hydration and hydrogen bonding of carbonyls in dimyristoyl-phosphatidylcholine bilayer 196
Metadynamics simulation of prion protein: β-structure stability and the early stages of misfolding 196
Hummer and Szabo-like potential of mean force estimator for bidirectional nonequilibrium pulling experiments/simulations 196
Approximating nonequilibrium processes using a collection of surrogate diffusion models 193
Calculation of the elastic coherent neutron scattering spectra from molecular dynamics data: the NaCN plastic crystal 192
Conformational distribution of gas-phase glycerol 192
Computing Free Energy Differences of Configurational Basins 190
Binding Free Energies of Host-Guest Systems by Nonequilibrium Alchemical Simulations with Constrained Dynamics: Illustrative Calculations and Numerical Validation 190
Glycerol condensed phases Part I. A molecular dynamics study 187
Simulated structure, dynamics and vibrational spectra of liquid benzene 185
Thermodynamics of stacking interactions in proteins 185
Improving fast-switching free energy estimates by dynamical freezing 185
Dynamics of liquid benzene: A cage analysis 185
Towards a polarizable force field for molecular liquids 184
Molecular dynamics of glass-forming liquids: Structure and dynamics of liquid metatoluidine 184
Numerical verification of the generalized Crooks nonequilibrium work theorem for non-Hamiltonian molecular dynamics simulations 184
Problems in molecular dynamics of condensed phases 183
Crooks equation for steered molecular dynamics using a Nosé-Hoover thermostat 180
Path-breaking schemes for nonequilibrium free energy calculations 180
Tuning the emission properties of fluorescent ligands by changing pH: the unusual case of an acridine-containing polyamine macrocycle 180
Dynamical and structural correlation in supercooled liquids: a molecular dynamics investigation of m-toluidine 179
Comment on “From Subtle to Substantial: Role of Metal Ions on π−π Interactions” 178
Correspondence between light-absorption spectrum and nonequilibrium work distribution as a mean to access free energy differences between electronic states 178
Comment on "Classical polarizable force fields parametrized from ab initio calculations" [J. Chem. Phys. 117, 1416 (2002)] 177
Computational Investigation of the Selective Cleavage of Diastereotopic Cyclopropane Bonds in 5-Spirocyclopropane Isoxazolidines Rearrangement 177
Comparing polarizable force fields to ab initio calculations reveals nonclassical effects in condensed phases 176
Density functional calculation of structural and vibrational properties of glycerol 176
The fast dynamics of benzene in the liquid phase. Part II. A molecular dynamics simulation 176
Comment to “Calculation of the Dipole Moment for Polypeptides Using the Generalized Born-Electronegativity Equalization Method: Results in Vacuum and Continuum-Dielectric Solvent” 175
Structural properties of a membrane associated anchor dipeptide 175
Inorganic Anion Recognition in Aqueous Solution by Coupling Nearby Highly Hydrophilic and Hydrophobic Moieties in a Macrocyclic Receptor 173
A potential of mean force estimator based on nonequilibrium work exponential averages 173
Self-healing umbrella sampling: a non-equilibrium approach for quantitative free energy calculations 170
Energetic fitness of histidine protonation states in PDB structures 168
Structure of liquid formic acid investigated by first principle and classical molecular dynamics simulations 167
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 167
Serial generalized ensemble simulations of biomolecules with self-consistent determination of weights 167
Calculation of the potential of mean force from nonequilibrium measurements via maximum likelihood estimators 166
Recovering the Crooks equation for dynamical systems in the isothermal-isobaric ensemble: A strategy based on the equations of motion 166
Nonequilibrium work relations for systems subject to mechanical and thermal changes 165
Key role of the polarization anisotropy of water in modeling classical polarizable force fields 165
Glycerol condensed phases part II. A molecular dynamics study of the conformational structure and hydrogen bonding 164
Polarization response of water and methanol investigated by a polarizable force field and density functional theory calculations: Implications for charge transfer 164
Toward quantitative estimates of binding affinities for protein-ligand systems involving large inhibitor compounds: A steered molecular dynamics simulation route 162
Optimal weights in serial generalized-ensemble simulations 161
Molecular mechanics and dynamics calculations to bridge molecular structure information and spectroscopic measurements on complexes of aromatic compounds 159
Is the T-shaped toluene dimer a stable intermolecular complex? 156
Domain formation in lipid bilayers probed by two-dimensional infrared spectroscopy 155
Nonequilibrium candidate Monte Carlo simulations with configurational freezing schemes 155
Stacking and T-shape competition in aromatic−aromatic amino acid interactions 154
Simulations in generalized ensembles through noninstantaneous switches 153
Erratum: “Calculation of optical spectra in liquid methanol using molecular dynamics and the chemical potential equalization method” [J. Chem. Phys. 111, 4218 (1999)] 152
Dynamics and structure of liquid and supercooled liquid m-toluidine investigated by molecular dynamics simulations 151
Excitonic effects in the 2DIR spectra of liquid formamide 150
Free volume from molecular dynamics simulations and its relationships to the positron annihilation lifetime spectroscopy 150
Elastic barrier dynamical freezing in free energy calculations: A way to speed up nonequilibrium molecular dynamics simulations by orders of magnitude 150
Retrieval of spectral and dynamic properties from two-dimensional infrared pump-probe experiments 146
Local sampling in steered Monte Carlo simulations decreases dissipation and enhances free energy estimates via nonequilibrium work theorems 146
II. Dissociation free energies in drug–receptor systems via nonequilibrium alchemical simulations: application to the FK506-related immunophilin ligands 146
Nonequilibrium work theorems applied to transitions between configurational domains 145
Modelling of the elementary steps involved in the aluminum electrochemical deposition from ionic liquid based solution: The BMIMCl/AlCl3 system 141
Excitonic effects in two-dimensional vibrational spectra of liquid formamide 136
The fast dynamics of benzene in the liquid phase. Part I. Optical Kerr effect experimental investigation 135
Excited state photoelectron spectroscopy of anisole 133
Indigo chromophores and pigments: Structure and dynamics 132
Esperimenti numerici: metodi e applicazioni 129
ORAC: A molecular dynamics simulation program to explore free energy surfaces in biomolecular systems at the atomistic level 126
Polarization entanglement of sum-frequency photons: A tool to probe the Markovian limit 126
The nature of intermolecular interactions between aromatic amino acid residues 126
Insights into positron annihilation lifetime spectroscopy by molecular dynamics simulations. Free-volume calculations for liquid and glassy glycerol 122
Misfolding pathways of the prion protein probed by molecular dynamics simulations 122
Anisole-CO2 a planar van der Waals complex: Comparison of different spectroscopic and theoretical results 120
Generalization of the Jarzynski and Crooks nonequilibrium work theorems in molecular dynamics simulations 119
The absorption spectrum of anisole and the anisole/CO2 1:1-cluster. The influence of intermolecular interaction on intramolecular vibrations 119
Fluorescence emissions and torsional conformations in pi-conjugated chains of PolyDCHD-HS 118
The ultrafast dynamics of liquid 1-octanol measured by femtosecond optical Kerr effect 118
Resolving capacity of infrared–visible sum frequency generation microscopy to address discrete structural realizations of a protein at interface 110
Totale 17.718
Salva come PNG Salva come JPEG
Categoria #
all - tutte 49.381
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 49.381
Salva come PNG Salva come JPEG


Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021217 0 0 0 0 0 0 0 0 0 0 84 133
2021/2022777 77 97 81 26 16 36 48 42 18 45 126 165
2022/20231.870 203 331 62 151 176 324 262 88 151 21 58 43
2023/2024545 33 80 110 28 39 33 35 131 5 13 27 11
2024/20254.568 122 460 300 676 1.484 776 45 272 147 86 117 83
2025/20263.971 463 612 316 262 570 207 579 251 312 360 39 0
Totale 18.504