IRIS
GUIDONI, LEONARDO
 Distribuzione geografica
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Continente #
NA - Nord America 5.753
AS - Asia 3.314
EU - Europa 3.240
SA - Sud America 468
AF - Africa 58
Continente sconosciuto - Info sul continente non disponibili 9
OC - Oceania 2
Totale 12.844
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Nazione #
US - Stati Uniti d'America 5.671
SG - Singapore 1.265
CN - Cina 808
IE - Irlanda 740
RU - Federazione Russa 689
BR - Brasile 396
SE - Svezia 386
TR - Turchia 349
DE - Germania 331
HK - Hong Kong 329
VN - Vietnam 317
IT - Italia 231
GB - Regno Unito 222
UA - Ucraina 193
FR - Francia 142
FI - Finlandia 114
IN - India 59
CZ - Repubblica Ceca 43
CA - Canada 40
JP - Giappone 37
NL - Olanda 32
AR - Argentina 27
BD - Bangladesh 27
PL - Polonia 26
ZA - Sudafrica 25
MX - Messico 23
BE - Belgio 22
ID - Indonesia 19
ES - Italia 17
IQ - Iraq 17
EC - Ecuador 13
AT - Austria 11
PK - Pakistan 10
VE - Venezuela 10
EU - Europa 8
KR - Corea 8
UZ - Uzbekistan 8
NP - Nepal 7
PH - Filippine 7
AE - Emirati Arabi Uniti 6
AZ - Azerbaigian 6
CO - Colombia 6
KZ - Kazakistan 6
MA - Marocco 6
SA - Arabia Saudita 6
TN - Tunisia 6
BG - Bulgaria 5
JM - Giamaica 5
LT - Lituania 5
DK - Danimarca 4
DZ - Algeria 4
IL - Israele 4
PE - Perù 4
PY - Paraguay 4
SI - Slovenia 4
BO - Bolivia 3
CL - Cile 3
ET - Etiopia 3
JO - Giordania 3
KE - Kenya 3
MY - Malesia 3
SK - Slovacchia (Repubblica Slovacca) 3
TH - Thailandia 3
TT - Trinidad e Tobago 3
BA - Bosnia-Erzegovina 2
DO - Repubblica Dominicana 2
EE - Estonia 2
EG - Egitto 2
HR - Croazia 2
HU - Ungheria 2
KG - Kirghizistan 2
NI - Nicaragua 2
OM - Oman 2
RO - Romania 2
SV - El Salvador 2
TW - Taiwan 2
AD - Andorra 1
AL - Albania 1
AU - Australia 1
BF - Burkina Faso 1
BN - Brunei Darussalam 1
BQ - ???statistics.table.value.countryCode.BQ??? 1
BY - Bielorussia 1
BZ - Belize 1
CG - Congo 1
CH - Svizzera 1
CI - Costa d'Avorio 1
CR - Costa Rica 1
GD - Grenada 1
GN - Guinea 1
GR - Grecia 1
GT - Guatemala 1
GY - Guiana 1
HN - Honduras 1
LA - Repubblica Popolare Democratica del Laos 1
LI - Liechtenstein 1
MD - Moldavia 1
MK - Macedonia 1
MN - Mongolia 1
MR - Mauritania 1
Totale 12.835
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Città #
Chandler 834
Singapore 795
Jacksonville 760
Dublin 738
San Jose 537
Dallas 463
Ashburn 329
Hong Kong 324
Santa Clara 270
Boardman 235
Nanjing 167
Izmir 166
New York 138
The Dalles 136
Moscow 131
Wilmington 126
San Mateo 116
Lawrence 103
Princeton 103
Ho Chi Minh City 98
Ann Arbor 89
Beijing 87
Lauterbourg 77
Hanoi 71
Los Angeles 71
Munich 68
Woodbridge 54
Rome 48
Milan 46
Des Moines 45
Nanchang 45
Falls Church 43
São Paulo 43
Columbus 42
Brno 39
Mountain View 37
Tokyo 36
Hefei 35
Shenyang 32
Seattle 29
Shanghai 28
Hebei 26
Amsterdam 25
Helsinki 24
Tianjin 24
Warsaw 24
Bremen 22
Brussels 22
Chicago 22
Denver 22
Orem 22
Jiaxing 21
Kunming 20
Chennai 19
Verona 19
Houston 18
Brooklyn 17
Changsha 17
Council Bluffs 17
Montreal 17
Dong Ket 16
L’Aquila 16
Da Nang 15
Boston 14
Guangzhou 14
Jinan 14
Johannesburg 14
Jakarta 13
Falkenstein 12
London 12
Norwalk 12
Belo Horizonte 11
Phoenix 11
Rio de Janeiro 11
San Francisco 11
Stockholm 11
Haiphong 10
Hangzhou 10
Lappeenranta 9
Assago 8
Biên Hòa 8
Hải Dương 8
Manchester 8
Ningbo 8
Poplar 8
Tappahannock 8
Toronto 8
Zhengzhou 8
Brasília 7
Campinas 7
Curitiba 7
Düsseldorf 7
Florence 7
Frankfurt am Main 7
Mexico City 7
Ribeirão Preto 7
Washington 7
Ankara 6
Charlotte 6
Dearborn 6
Totale 8.421
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Nome #
QM/MM dynamics of a Peridinin model in triplet state in three prototypical solvents 185
A molecular dynamics-guided mutagenesis identifies two aspartic acid residues involved in the pH-dependent activity of OG-OXIDASE 1 158
Vibrational Spectra of Water Solutions of Azoles from QM/MM Calculations: Effects of Solvation 152
Mechanism of Oxygen Evolution and Mn4CaO5 Cluster Restoration in the Natural Water-Oxidizing Catalyst 148
A Spotlight on the Compatibility between XFEL and Ab Initio Structures of the Oxygen Evolving Complex in Photosystem II 147
Structural and dynamical characterization of the S4 state of the Kok-Joliot's cycle by means of QM/MM Molecular Dynamics Simulations 146
Molecular dynamics of an asymmetric form of GabR, a bacterial transcriptional regulator 138
Early-stage formation of (hydr)oxo bridges in transition-metal catalysts for photosynthetic processes 136
Molecular dynamics simulations and kinetic measurements provide insights into the structural requirements of substrate size-dependent specificity of oligogalacturonide oxidase 1 (OGOX1) 135
Static and Dynamical Correlation in Diradical Molecules by Quantum Monte Carlo Using the Jastrow Antisymmetrized Geminal Power Ansatz 135
Role of Electron Correlation along the Water Splitting Reaction 134
Vibrational fingerprints of the Mn4CaO5 cluster in Photosystem II by mixed quantum-classical molecular dynamics 134
Molecular Properties by Quantum Monte Carlo: An Investigation on the Role of the Wave Function Ansatz and the Basis Set in the Water Molecule 133
Dissecting the Hydrogen Bond: A Quantum Monte Carlo Approach 132
Characterization of the Sr2+- and Cd2+-Substituted Oxygen-Evolving Complex of Photosystem II by Quantum Mechanics/Molecular Mechanics Calculations 129
Quantum monte carlo treatment of the charge transfer and diradical electronic character in a retinal chromophore minimal model 129
Theoretical optical spectroscopy of complex systems 129
Magnetic interactions in the catalyst used by nature to split water: a DFT plus U multiscale study on the Mn4CaO5 core in photosystem II 128
Early Steps of the Intramolecular Signaling Pathway in Rhodopsin Explored by Molecular Dynamics Simulations 127
QM/MM Study of Rhodopsin 127
Wave Function Adapted Hamiltonians for Quantum Computing 127
Kohn-Sham orbitals and potentials from quantum Monte Carlo molecular densities 126
Chemical and protein shifts in the spectrum of the photoactive yellow protein: a time-dependent density functional theory/molecular mechanics study 126
The dynamics of the special pair of chlorophylls of Photosystem II 126
Potassium and sodium binding to the outer mouth of the K+ channel 124
π-Conjugation in trans -1,3-Butadiene: Static and dynamical electronic correlations described through quantum monte carlo 124
Water and potassium dynamics inside the KcsA K+ channel 123
Valence-Bond states in dynamical Jahn-Teller Molecular systems 123
QM/MM Simulation of the first step of vision 122
Molecular Vibrations of an Oxygen-Evolving Complex and Its Synthetic Mimic 122
Hidden Hydration Structure of Halide Ions: An Insight into the Importance of Lone Pairs 121
Tetraethylammonium binding to the outer mouth of the KcsA potassium channel: implications for ion permeation 120
Protein field effect on the dark state of 11-cis Retinal in Rhodopsin by Quantum Monte Carlo / Molecular Mechanics 119
Contact Ion Pairs on a Protonated Azamacrocycle: The Role of the Anion Basicity 119
Ground state structures and electronic excitations of biological chromophores at Quantum Monte Carlo/Many Body Green's Function Theory level 118
Impact of molecular flexibility on the site energy shift of chlorophylls in Photosystem II 117
Structural and dynamic insights into Mn4Ca cluster-depleted Photosystem II 117
Vibrational Signature of Water Molecules in Asymmetric Hydrogen Bonding Environments 116
One-Electron Oxidation of Methionine-Containing Dipeptides of Reverse Sequence: Sulfur versus Sulfoxide Characterized by IRMPD Spectroscopy and Static and Dynamics DFT Simulations 116
Protonated pyrimidine nucleosides probed by IRMPD spectroscopy 115
Magnetic coupling constants and vibrational frequencies by extended broken symmetry approach with hybrid functionals. 115
Structural and vibrational study of 2-MethoxyEthylAmmonium Nitrate (2-OMeEAN): Interpretation of experimental results with ab initio molecular dynamics 115
Evolution from S3 to S4 States of the Oxygen-Evolving Complex in Photosystem II Monitored by Quantum Mechanics/Molecular Mechanics (QM/MM) Dynamics 115
Pivotal role of the redox-active tyrosine in driving the water splitting catalyzed by photosystem II 115
Fermi Resonance as a Tool for Probing Peridinin Environment 114
Spin liquid ground state in a two dimensional non-frustrated spin model 113
Polarization effects and charge transfer in the KcsA Potassium Channel 113
Molecular Modelling and Simulations of Light-Harvesting Decanuclear Ru-Based Dendrimers for Artificial Photosynthesis 113
The Impact of Nitric Oxide Toxicity on the Evolution of the Glutathione Transferase Superfamily. A proposal for an evolutionary driving force. 112
Quantum Monte Carlo study of the Retinal Minimal Model C5H6NH+2 112
Bathochromic Shift in Green Fluorescent Protein: A Puzzle for QM/MM Approaches 111
Coordination numbers of K+ and Na+ ions inside the selectivity filter of the KcsA potassium channel: Insights from first principles molecular dynamics 111
Molecular Electrical Properties from Quantum Monte Carlo Calculations: Application to Ethyne 111
Environmental Effects on Vibrational Properties of Carotenoids: Experiments and Calculations on Peridinin 110
Potassium permeation through the KcsA channel: a density functional study 110
Optimized Structure and Vibrational Properties by Error Affected Potential Energy Surfaces 110
Reorganization of Substrate Waters between the Closed and Open Cubane Conformers during the S2 to S3 Transition in the Oxygen Evolving Complex 109
Asymmetric Environmental Effects on the Structure and Vibrations of cis-[Pt(NH3)(2)Cl-2] in Condensed Phases 108
Structural Optimization by Quantum Monte Carlo: Investigating the Low-Lying Excited States of Ethylene 108
Geometries of low spin states of multi-centre transition metal complexes through extended broken symmetry variational Monte Carlo 107
Experimental and theoretical study of intramolecular exchange in Ir2Rh2(CO)12 and Ir4(CO)11(m-SO2) 106
Protonated hexaazamacrocycles as selective K+ receptors 106
Developing Improved Charge Sets for the Modeling of the KcsA K+ Channel Using QM/MM Electrostatic Potential 104
Reaction Pathways for Oxygen Evolution Promoted by Cobalt Catalyst 104
Reaction pathways by Quantum Monte Carlo: insight on the torsion barrier of 1,3-butadiene, and the conrotatory ring opening of cyclobutene 103
Copper binding sites in the C-terminal domain of mouse prion protein: a hybrid (QM/MM) molecular dynamics study 103
On the comparison between differential vibrational spectroscopy spectra and theoretical data in the carboxyl region of photosystem II 103
On the hydration properties of the bromide aqua ion: the interplay of first principle and classical Molecular Dynamics, and X-ray absorption spectroscopy 102
Phase separation in the 2D Hubbard model: a fixed-node quantum Monte Carlo study 102
Hydration Structure of the Quaternary Ammonium Cations 102
The origin of the chemoselectivity in the Cp2TiCl2/MAO catalyst for the polymerization of 1,3-butadiene explored by Density Functional Theory 102
Improved Accuracy on Noisy Devices by Nonunitary Variational Quantum Eigensolver for Chemistry Applications 102
Vibrational Signatures of S-Nitrosoglutathione as Gaseous, Protonated Species 101
Protonation state of the chromophore in the photoactive yellow protein 101
Scanning Reactive Pathways with Orbital Biased Molecular Dynamics 101
H/D Isotope Effects Reveal Factors Controlling Catalytic Activity in Co-Based Oxides for Water Oxidation 101
Targeted Delivery of Lidocaine in Breast Cancer Cells via Zeolitic Imidazolate Framework‐8 Nanoparticles 100
Pathway for Mn-cluster oxidation by tyrosine-Z in the S-2 state of photosystem II 100
Molecular dynamics simulation unveils the conformational flexibility of the interdomain linker in the bacterial transcriptional regulator GabR from Bacillus subtilis bound to pyridoxal 5'-phosphate 99
The electron-proton bottleneck of photosynthetic oxygen evolution 98
Effects of Static Correlation between Spin Centers in Multicenter Transition Metal Complexes 98
ZIF-8 as Potential Vector for Enhanced Target Delivery of Sulfathiazole for the Treatment of Bovine Ruminal Acidosis 97
The S-2 State of the Oxygen-Evolving Complex of Photosystem II Explored by QM/MM Dynamics: Spin Surfaces and Metastable States Suggest a Reaction Path Towards the S-3 State 97
Overcoming the Inadequacy of X-ray Powder Diffraction in Reliable Hydrogen Location with the Aid of First Principles Calculations: Crystal Structure Determination of Orotaldehyde Monohydrate 97
Spin gap in low-dimensional Mott insulators with orbital degeneracy 96
Many-body study of the photoisomerization of the minimal model of the retinal protonated Schiff base 96
Quantum Mechanical/Molecular Mechanical (QM/MM) Car-Parrinello Simulations in Excited States 96
Unveiling the Influence of Hydrated Deep Eutectic Solvents on the Dynamics of Water–Soluble Proteins 95
Hybrid QM/MM Car-Parrinello Simulations of Catalytic and Enzymatic Reactions 95
Extended wavefunctions for the Variational Quantum Eigensolver 95
Mechanism of Water Delivery to the Active Site of Photosystem II along the S2 to S3 Transition 95
Investigation of the Entry Pathway and Molecular Nature of σ1 Receptor Ligands 94
A Molecular Spring for Vision 94
Effect of Phase Noise in Superconducting Qubit Control 93
Properties of reactive oxygen species by quantum Monte Carlo 93
Tautomerism in liquid 1,2,3-triazole: a combined energy-dispersive X-ray diffraction, molecular dynamics, and FTIR study 92
Unravelling Mn4Ca cluster vibrations in the S1, S2 and S3 states of the Kok–Joliot cycle of photosystem II 92
The protonation state of the Glu-71/Asp-80 residues in the KcsA Potassium Channel. A first principles QM/MM Molecular Dynamics Study 90
Protonation States in a Cobalt-Oxide Catalyst for Water Oxidation: Fine Comparison of Ab Initio Molecular Dynamics and X-ray Absorption Spectroscopy Results 90
Multiple Steering Molecular Dynamics Applied to Water at Alkali Ions 89
Totale 11.359
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Categoria #
all - tutte 51.795
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 51.795
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021279 0 0 0 0 0 0 0 0 0 47 172 60
2021/2022718 42 50 154 51 49 28 19 31 56 18 39 181
2022/20232.267 159 133 57 244 171 268 2 176 944 12 68 33
2023/2024499 79 38 29 58 32 130 11 13 1 27 8 73
2024/20252.096 63 41 168 48 252 201 319 223 374 65 194 148
2025/20264.481 203 514 462 589 473 347 821 154 398 520 0 0
Totale 12.997