CRIS Current Research Information System

RIVALTA, IVAN
 Distribuzione geografica
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Continente #
AS - Asia 7.295
NA - Nord America 6.788
EU - Europa 5.889
SA - Sud America 412
AF - Africa 286
OC - Oceania 8
Continente sconosciuto - Info sul continente non disponibili 7
Totale 20.685
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Nazione #
US - Stati Uniti d'America 6.674
CN - Cina 2.023
SG - Singapore 1.914
VN - Vietnam 1.642
IT - Italia 1.254
DE - Germania 1.233
NL - Olanda 839
GB - Regno Unito 804
HK - Hong Kong 465
SE - Svezia 377
KR - Corea 323
FR - Francia 307
BR - Brasile 300
IN - India 300
RU - Federazione Russa 210
FI - Finlandia 188
IE - Irlanda 149
JP - Giappone 124
JO - Giordania 101
BD - Bangladesh 100
ZA - Sudafrica 99
ES - Italia 65
UA - Ucraina 65
EE - Estonia 63
CH - Svizzera 58
CA - Canada 56
CI - Costa d'Avorio 51
ID - Indonesia 51
AT - Austria 46
AR - Argentina 43
PL - Polonia 42
TH - Thailandia 40
BE - Belgio 38
TW - Taiwan 38
TG - Togo 36
SC - Seychelles 35
PH - Filippine 34
IQ - Iraq 32
BG - Bulgaria 31
PK - Pakistan 29
MX - Messico 25
DK - Danimarca 24
EC - Ecuador 24
HR - Croazia 19
CO - Colombia 15
NG - Nigeria 15
UZ - Uzbekistan 15
CL - Cile 14
NO - Norvegia 14
SA - Arabia Saudita 13
MA - Marocco 12
PT - Portogallo 12
TR - Turchia 12
CZ - Repubblica Ceca 11
LT - Lituania 10
JM - Giamaica 7
LB - Libano 7
RO - Romania 7
AU - Australia 6
GR - Grecia 6
PY - Paraguay 6
ET - Etiopia 5
EU - Europa 5
KE - Kenya 5
CR - Costa Rica 4
DZ - Algeria 4
HN - Honduras 4
IR - Iran 4
RS - Serbia 4
SI - Slovenia 4
VE - Venezuela 4
AE - Emirati Arabi Uniti 3
EG - Egitto 3
KZ - Kazakistan 3
LY - Libia 3
MY - Malesia 3
PA - Panama 3
SN - Senegal 3
TN - Tunisia 3
UY - Uruguay 3
BO - Bolivia 2
CM - Camerun 2
DO - Repubblica Dominicana 2
GA - Gabon 2
GE - Georgia 2
GT - Guatemala 2
KW - Kuwait 2
LA - Repubblica Popolare Democratica del Laos 2
MG - Madagascar 2
NP - Nepal 2
OM - Oman 2
PR - Porto Rico 2
PS - Palestinian Territory 2
SY - Repubblica araba siriana 2
AL - Albania 1
AN - Antille olandesi 1
AO - Angola 1
AZ - Azerbaigian 1
BA - Bosnia-Erzegovina 1
BB - Barbados 1
Totale 20.657
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Città #
Singapore 1.331
Ashburn 760
Frankfurt am Main 727
Fairfield 706
Eygelshoven 690
Southend 657
Hefei 639
Hong Kong 437
San Jose 426
Bologna 393
Santa Clara 381
Ho Chi Minh City 368
Woodbridge 355
Hanoi 345
Houston 344
Seattle 304
Seoul 302
Wilmington 252
Chandler 233
Cambridge 229
Dallas 212
Beijing 195
Boardman 191
Princeton 177
Ann Arbor 160
Dublin 147
Dong Ket 145
Helsinki 138
Lauterbourg 129
Milan 104
Amman 101
Council Bluffs 98
Tokyo 93
Los Angeles 80
Nanjing 74
Da Nang 71
Westminster 70
Redondo Beach 65
Bengaluru 63
Berlin 60
Abidjan 51
Buffalo 50
Redmond 49
Haiphong 48
Cesena 47
Jinan 44
Guangzhou 42
Falkenstein 41
Turin 40
Shanghai 39
São Paulo 39
Zurich 39
San Diego 38
Shenyang 38
Saint Petersburg 37
Lomé 36
Brussels 35
Lappeenranta 35
New York 35
Rome 35
Olalla 32
Warsaw 32
Kerkrade 30
Sofia 30
Munich 29
Amsterdam 28
Changsha 28
Dearborn 28
Vienna 28
Jakarta 27
London 27
Nuremberg 27
Kyiv 26
Tianjin 26
Bremen 25
Padova 24
Secaucus 24
Atlanta 23
Nanchang 22
Rimini 22
Tongling 22
Phoenix 21
Chicago 20
Falls Church 20
Hangzhou 20
The Dalles 20
Hebei 19
Johannesburg 19
Norwalk 19
Pisa 19
Zhengzhou 19
Biên Hòa 18
Cardiff 17
Forlì 17
Des Moines 16
Orem 16
Thái Nguyên 16
Stockholm 15
Toronto 15
Turku 15
Totale 13.971
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Nome #
Retinal photoisomerization versus counterion protonation in light and dark-adapted bacteriorhodopsin and its primary photoproduct 1.049
Quantum-Classical Protocol for Efficient Characterization of Absorption Lineshape and Fluorescence Quenching upon Aggregation: The Case of Zinc Phthalocyanine Dyes 954
Boosting the guerbet reaction: A cooperative catalytic system for the efficient bio-ethanol refinery to second-generation biofuels 347
Is DFT enough? Towards Accurate High-Throughput Computational Screening of Azobenzenes for Molecular Solar Thermal Applications 265
First-principles characterization of the singlet excited state manifold in DNA/RNA nucleobases 249
Combined computational-experimental study of Ru(0)-catalyzed Guerbet reaction 247
Probing deactivation pathways of DNA nucleobases by two-dimensional electronic spectroscopy: first principles simulations 227
Bimetallic Co-M (M = Cu, Ag, and Au) Carbonyl Complexes Supported by N-Heterocyclic Carbene Ligands: Synthesis, Structures, Computational Investigation, and Catalysis for Ammonia Borane Dehydrogenation 218
COBRAMM 2.0 — A software interface for tailoring molecular electronic structure calculations and running nanoscale (QM/MM) simulations 217
Characterizing Counterion-Dependent Aggregation of Rhodamine B by Classical Molecular Dynamics Simulations 215
A theoretical study of ethylene dehydrogenation by bare Niobium atom and cation 207
Influence of stabilisers on the catalytic activity of supported Au colloidal nanoparticles for the liquid phase oxidation of glucose to glucaric acid: understanding the catalyst performance from NMR relaxation and computational studies 204
Two-dimensional electronic spectroscopy as a tool for tracking molecular conformations in DNA/RNA aggregates 204
The Guerbet reaction kinetic enigma; how co-catalysts play a crucial role in the catalytic cycle 202
Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table 200
Ultraviolet vision: photophysical properties of the unprotonated retinyl Schiff base in the Siberian hamster cone pigment 198
Tracking excited state decay mechanisms of pyrimidine nucleosides in real time 195
Multiple Decay Mechanisms and 2D-UV Spectroscopic Fingerprints of Singlet Excited Solvated Adenine-Uracil Monophosphate 194
Allostery in Its Many Disguises: From Theory to Applications 193
Ultrafast Carotenoid to Retinal Energy Transfer in Xanthorhodopsin Revealed by the Combination of Transient Absorption and Two-Dimensional Electronic Spectroscopy 190
Modeling solvent effects and convergence of 31P‐NMR shielding calculations with COBRAMM 183
Ab initio simulations of two-dimensional electronic spectra: The SOS//QM/MM approach 182
UV-induced long-lived decays in solvated pyrimidine nucleosides resolved at the MS-CASPT2/MM level 181
Optimal-tuning of range-separated density functionals to describe the optical and photophysical properties of rhodamine B dimers 179
Towards Accurate Simulation of Two-Dimensional Electronic Spectroscopy 179
Bidimensional electronic spectroscopy on indole in gas phase and in water from first principles 174
BOOSTING THE GUERBET REACTION: A COOPERATIVE HOMOGENEOUS CATALYTIC SYSTEM FOR BIOETHANOL REFINERY TO SECOND-GENERATION BIOFUELS 173
The highly excited-state manifold of guanine: calibration for nonlinear electronic spectroscopy simulations 168
Allosteric pathways in imidazole glycerol phosphate synthase 167
Structure-activity relationships of ZrO2 crystalline phases in the catalytic transfer hydrogenation of methyl levulinate with ethanol 166
Excited state evolution of DNA stacked adenines resolved at the CASPT2//CASSCF/Amber level: from the bright to the excimer state and back 166
Modeling the high-energy electronic state manifold of adenine: Calibration for nonlinear electronic spectroscopy 166
Activation of methane by the iron dimer cation. A theoretical study 166
Acetylene cyclotrimerization by early second-row transition metals in the gas phase. A theoretical study 166
Spectral lineshapes in nonlinear electronic spectroscopy 166
Effect of Capping Ligands for the Synthesis of Gold Nanoparticles and on the Catalytic Performance for the Oxidation of 5-Hydroxymethyl-2-furfural 164
Fine Tuning of Retinal Photoinduced Decay in Solution 164
The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry 163
The effect of solvent relaxation in the ultrafast time-resolved spectroscopy of solvated benzophenone 163
Protospacer Adjacent Motif-Induced Allostery Activates CRISPR-Cas9 163
Photo-Active Biological Molecular Materials: From Photoinduced Dynamics to Transient Electronic Spectroscopies 162
Characterization of Protein Tyrosine Phosphatase 1B Inhibition by Chlorogenic Acid and Cichoric Acid 161
Characterizing Conical Intersections in DNA/RNA Nucleobases with Multiconfigurational Wave Functions of Varying Active Space Size 160
Two State Reactivity Paradigm in Catalysis. The Example of X-H (X = O, N, C) and C-C Bonds Activation Mediated by Transition Metal Compounds 160
Characterization of an amorphous iridium water-oxidation catalyst electrodeposited from organometallic precursors 160
How to bring alcohols out of the Guerbet’s labyrinth: an efficient homogeneous catalytic approach 159
Eigenvector centrality for characterization of protein allosteric pathways 159
Modeling multidimensional spectral lineshapes from first principles: Application to water-solvated adenine 159
RUTHENIUM BIFUNCTIONAL BASED CATALYTIC SYSTEMS TO TUNE EFFICENCY AND SELECTIVITY IN ALCOHOL HOMOLOGATION 157
Theoretical study of the gas-phase ethane C-H and C-C bonds activation by bare niobium cation 157
Modelling quenching mechanisms of disordered molecular systems in the presence of molecular aggregates 157
ACS Sustainable Chemistry & Engineering 156
The carbonyl-lock mechanism underlying non-aromatic fluorescence in biological matter 155
Polymerization isomerism in co-m (M = cu, ag, au) carbonyl clusters: Synthesis, structures and computational investigation 155
Noncollinear spins provide a self-consistent treatment of the low-spin state of a biomimetic oxomanganese synthetic trimer inspired by the oxygen evolving complex of photosystem II 151
Theoretical Model of the Protochlorophyllide Oxidoreductase from a Hierarchy of Protocols 150
Tracking Conformational Dynamics of Polypeptides by Nonlinear Electronic Spectroscopy of Aromatic Residues: A First-Principles Simulation Study 149
Predicting the exchange coupling constant in a diiron complex 148
Experimental and theoretical study on the homogeneous catalyzed Guerbet reaction with ruthenium-NHC complexes 148
Two-Dimensional Electronic Spectroscopy of Benzene, Phenol, and Their Dimer: An Efficient First-Principles Simulation Protocol 148
Two-dimensional UV spectroscopy: A new insight into the structure and dynamics of biomolecules 148
Resolving the Singlet Excited State Manifold of Benzophenone by First-Principles Simulations and Ultrafast Spectroscopy 147
Adsorption of ethylene, vinyl, acetic acid, and acetate species on PdAu(111) and PdAu(100) surface alloys: A cluster model study 147
Atomic configurations of Pd atoms in PdAu(1 1 1) and PdAu(1 0 0) surface alloys: Ab initio density functional calculations 144
Experimental and theoretical study on the homogeneous catalyzed Guerbet reaction with ruthenium-NHC complexes 143
Allosteric Communication Disrupted by a Small Molecule Binding to the Imidazole Glycerol Phosphate Synthase Protein-Protein Interface 143
UNRAVELLING THE MECHANISM OF THE GUERBET REACTION USING A RUTHENIUM CATALYST: A SYNERGISTIC COMPUTATIONAL AND EXPERIMENTAL STUDY 142
Tracking the primary photoconversion events in rhodopsins by ultrafast optical spectroscopy 141
Spectral tuning of ultraviolet cone pigments: An interhelical lock mechanism 140
Allosteric Pathways in the PPARγ 3-RXRα nuclear receptor complex 140
Structural-functional role of chloride in photosystem II 139
Solution NMR and computational methods for understanding protein allostery 139
Community Network Analysis of Allosteric Proteins 139
Modelling retinal chromophores photoisomerization: from minimal models in vacuo to ultimate bidimensional spectroscopy in rhodopsins 138
Theoretical investigation of the mechanism of acid-catalyzed oxygenation of a Pd(II)-hydride to produce a Pd(II)-hydroperoxide 138
Triplet Oxygen Evolution Catalyzed by a Biomimetic Oxomanganese Complex: Functional Role of the Carboxylate Buffer 136
Facile ecofriendly synthesis of monastrol and its structural isomers via biginelli reaction 136
Computational Studies of the Oxygen-Evolving Complex of Photosystem II and Biomimetic Oxomanganese Complexes for Renewable Energy ApplicationsApplications of Molecular Modeling to Challenges in Clean Energy 135
Structural Studies of Oxomanganese Complexes for Water Oxidation Catalysis 135
S1-state model of the O2-evolving complex of photosystem II 134
Oxomanganese complexes for natural and artificial photosynthesis 134
Homogeneous Green Conversion of the Bio-Based Platform HMF (5-Hydroxymethylfurfural) into BHMF (2,5-Bis(hydroxymethyl)furan): Synthesis and LCA (Life Cycle Assessment) 133
Disentangling Peptide Configurations via Two-Dimensional Electronic Spectroscopy: Ab Initio Simulations Beyond the Frenkel Exciton Hamiltonian 132
Key role of the REC lobe during CRISPR-Cas9 activation by 'sensing', 'regulating', and 'locking' the catalytic HNH domain 132
Interaction of CO with PdAu(111) and PdAu(100) bimetallic surfaces: A theoretical cluster model study 132
The role of quantum chemistry in the elucidation of the elementary mechanisms of catalytic processes: From atoms, to surfaces, to enzymes 132
Connected Component Analysis of Dynamical Perturbation Contact Networks 131
Theoretical and experimental study on the role of benzoquinone in the homogeneous catalyzed Guerbet reaction 131
Methane activation by chromium oxide cations in the gas phase: A theoretical study 130
The influence of surface oxygen and hydroxyl groups on the dehydrogenation of ethylene on PdAu surface alloys. A theoretical cluster model study 129
SYNERGISTIC COMPUTATIONAL AND EXPERIMENTAL STUDY OF THE MECHANISM OF THE RU-CATALYSED GUERBET REACTION 128
Singular Interface Dynamics of the SARS-CoV-2 Delta Variant Explained with Contact Perturbation Analysis 127
Simulating Plasmon Resonances of Gold Nanoparticles with Bipyramidal Shapes by Boundary Element Methods 126
Heterometallic rhodium clusters as electron reservoirs: Chemical, electrochemical, and theoretical studies of the centered-icosahedral [Rh12E(CO)27]n− atomically precise carbonyl compounds 126
Boosting the Guerbet reaction: a cooperative homogeneous catalytic system for bioethanol refinery to second-generation biofuels 126
The geometric effect in palladium-gold catalysis. Is the coupling the rate-determining step in the vinyl-acetate synthesis? 125
Reengineering rate-limiting, millisecond enzyme motions by introduction of an unnatural amino acid 125
UNRAVELLING THE MECHANISM OF THE GUERBET REACTION USING A RUTHENIUM CATALYST: A SYNERGISTIC COMPUTATIONAL AND EXPERIMENTAL STUDY 124
Insight on Chirality Encoding from Small Thiolated Molecule to Plasmonic Au@Ag and Au@Au Nanoparticles 123
Modelling Time-Resolved Two-Dimensional Electronic Spectroscopy of the Primary Photoisomerization Event in Rhodopsin 121
Totale 17.856
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Categoria #
all - tutte 56.207
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 56.207
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021297 0 0 0 0 0 0 0 0 0 0 0 297
2021/20221.562 160 24 108 95 165 73 57 168 86 38 327 261
2022/20231.819 124 195 77 209 107 119 51 163 368 73 152 181
2023/2024822 81 108 44 79 71 94 69 78 19 61 78 40
2024/20253.438 89 482 269 225 524 175 235 209 65 164 274 727
2025/20269.333 641 1.077 868 611 576 1.115 1.257 277 1.646 661 351 253
Totale 21.217