Bicocca Open Archive

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ARRIGONI, FEDERICA
 Distribuzione geografica
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Continente #
NA - Nord America 3.512
EU - Europa 2.581
AS - Asia 664
SA - Sud America 12
AF - Africa 7
OC - Oceania 6
Continente sconosciuto - Info sul continente non disponibili 1
Totale 6.783
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Nazione #
US - Stati Uniti d'America 3.449
IT - Italia 854
DE - Germania 565
CN - Cina 353
SE - Svezia 295
IE - Irlanda 272
GB - Regno Unito 134
HK - Hong Kong 122
VN - Vietnam 102
AT - Austria 97
UA - Ucraina 73
CA - Canada 63
FR - Francia 57
PL - Polonia 57
IN - India 45
DK - Danimarca 44
RU - Federazione Russa 41
FI - Finlandia 34
BE - Belgio 17
ES - Italia 16
TR - Turchia 15
BR - Brasile 11
IR - Iran 9
NO - Norvegia 9
NL - Olanda 7
AU - Australia 4
EG - Egitto 3
JP - Giappone 3
PK - Pakistan 3
RO - Romania 3
SG - Singapore 3
TW - Taiwan 3
KR - Corea 2
NG - Nigeria 2
NZ - Nuova Zelanda 2
AR - Argentina 1
AZ - Azerbaigian 1
CH - Svizzera 1
EU - Europa 1
GR - Grecia 1
HR - Croazia 1
HU - Ungheria 1
ID - Indonesia 1
IL - Israele 1
LB - Libano 1
PT - Portogallo 1
RS - Serbia 1
SC - Seychelles 1
ZA - Sudafrica 1
Totale 6.783
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Città #
Ann Arbor 1.228
Frankfurt am Main 402
Milan 291
Chandler 272
Dublin 262
Wilmington 227
Fairfield 203
Woodbridge 199
Ashburn 157
Houston 143
Hong Kong 120
New York 118
Vienna 97
Princeton 95
Seattle 91
Dearborn 87
Cambridge 75
Shanghai 69
Jacksonville 67
Dong Ket 53
Nanjing 53
Kraków 50
Fremont 37
Guangzhou 33
Lawrence 33
Beijing 27
Altamura 22
London 19
Nanchang 19
Ottawa 19
San Diego 19
Toronto 19
Helsinki 17
Jinan 16
Brussels 15
Falls Church 14
Hangzhou 14
Pune 14
Rome 14
Boardman 13
Edmonton 12
Tianjin 12
Zhengzhou 11
Como 10
Grafing 10
Hebei 10
Lachine 10
Vimercate 10
Andover 9
Changchun 9
Shenyang 9
Bergen 8
Changsha 8
Marseille 8
Ningbo 8
Novate Milanese 8
Paris 8
Sesto San Giovanni 8
Carate Brianza 7
Washington 7
Ardabil 6
Barcelona 6
Bergamo 6
Brescia 6
Fasano 6
Los Angeles 6
Parma 6
Pioltello 6
Sacramento 6
Suzhou 6
Turin 6
Bologna 5
Brugine 5
Desio 5
Jiaxing 5
Kiev 5
Leawood 5
Norwalk 5
Nürnberg 5
Palermo 5
Radomsko 5
San Mateo 5
Cagliari 4
Cantù 4
Düren 4
Genoa 4
Kunming 4
Lanzhou 4
Lappeenranta 4
Lomazzo 4
Madrid 4
Monza 4
Naples 4
Oxford 4
Padova 4
Pavia 4
Taizhou 4
Trezzano sul Naviglio 4
Vimodrone 4
Abbiategrasso 3
Totale 5.097
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Nome #
On the reactivity of the most efficient iron-based catalyst for CO2 hydrogenation: a DFT picture 266
Chemistry and renewable energy: DFT investigation on CO2 reduction and H2 oxidation/production catalyzed by transition metal biomimics. 263
H2 Activation in [FeFe]-Hydrogenase Cofactor Versus Diiron Dithiolate Models: Factors Underlying the Catalytic Success of Nature and Implications for an Improved Biomimicry 236
Synthesis, Molecular Modeling and Biological Evaluation of Metabolically Stable Analogues of the Endogenous Fatty Acid Amide Palmitoylethanolamide 226
On the photochemistry of Fe2(edt)(CO)4(PMe3)2, a [FeFe]-hydrogenase model: A DFT/TDDFT investigation 215
First-Principles Calculations on Ni,Fe-Containing Carbon Monoxide Dehydrogenases Reveal Key Stereoelectronic Features for Binding and Release of CO2 to/from the C-Cluster 206
Rational Design of Fe2(μ-PR2)2(L)6 Coordination Compounds Featuring Tailored Potential Inversion 193
The Photochemistry of Fe2(S2C3H6)(CO)6(µ-CO) and Its Oxidized Form, Two Simple [FeFe]-Hydrogenase CO-Inhibited Models. A DFT and TDDFT Investigation 190
On the importance of cyanide in diiron bridging carbyne complexes, unconventional [FeFe]-hydrogenase mimics without dithiolate: An electrochemical and DFT investigation 189
Towards biomimetic models of the reduced [FeFe]-hydrogenase that preserve the key structural features of the enzyme active site; A DFT investigation 185
Preparation and Protonation of Fe2(pdt)(CNR)6, Electron-Rich Analogues of Fe2(pdt)(CO)6 180
On the propagation of the OH radical produced by Cu-amyloid beta peptide model complexes. Insight from molecular modelling 177
DFT Dissection of the Reduction Step in H2 Catalytic Production by [FeFe]-Hydrogenase-Inspired Models: Can the Bridging Hydride Become More Reactive Than the Terminal Isomer? 175
Computational approaches to the prediction of the redox potentials of iron and copper bioinorganic systems 170
Excited state properties of a [FeFe] hydrogenase active site models. The Time-Dependent Density Functional Theory theoretical picture 169
Investigations of the electronic-molecular structure of bio-inorganic systems using modern methods of quantum chemistry 169
Effect of Pyramidalization of the M2(SR)2 Center: The Case of (C5H5)2Ni2(SR)2 168
Triiron clusters derived from dinuclear complexes related to the active site of [Fe-Fe] hydrogenases: Steric effect of the dithiolate bridge on redox properties, a DFT analysis 166
Electron-Rich, Diiron Bis(monothiolato) Carbonyls: C-S Bond Homolysis in a Mixed Valence Diiron Dithiolate 164
Imine-Centered Reactions in Imino-Phosphine Complexes of Iron Carbonyls 158
Mechanistic Insight into Electrocatalytic H2 Production by [Fe2(CN)μ-CN(Me)2(μ-CO)(CO)(Cp)2]: Effects of Dithiolate Replacement in [FeFe] Hydrogenase Models 156
Copper reduction and dioxygen activation in Cu-amyloid beta peptide complexes: insight from molecular modelling 156
Catalytic H2 evolution/oxidation in [FeFe]-hydrogenase biomimetics: account from DFT on the interplay of related issues and proposed solutions 156
Excited state properties and photochemistry in [FeFe] hydrogenase research area. The Time-Dependent Density Functional Theory theoretical picture 155
Quantum Chemistry serving biotechnologies: the interesting case of metalloenzyme active sites 151
Redox potentials of small inorganic radicals and hexa-aquo complexes of first-row transition metals in water: a dft study based on the grand canonical ensemble 150
Computational investigation of proton reduction in [Fe-Fe]-hydrogenase bioinspired complexes: μ-H versus t-H 148
Influence of the Dithiolate Bridge on the Oxidative Processes of Diiron Models Related to the Active Site of [FeFe] Hydrogenases 139
Synthetic Designs and Structural Investigations of Biomimetic Ni-Fe Thiolates 138
Conjugation of gold nanoparticles with multidentate surfactants for enhanced stability and biological properties 131
DFT investigation of binding and redox properties of the Hox state of [FeFe]-hydrogenases 129
Proton Shuttle Mediated by (SCH2)2P= O Moiety in [FeFe]-Hydrogenase Mimics: Electrochemical and DFT Studies 127
Comparison of H2 oxidation in [FeFe]-hydrogenases and biomimetic models highlights key stereoelectronic features for catalysis. 108
Electrochemical and Theoretical Investigations of the Oxidatively Induced Reactivity of the Complex [Fe2(CO)4(κ2-dmpe)(μ-adtBn)] Related to the Active Site of [FeFe] Hydrogenases 99
Computational and Experimental Investigations of the Fe2(μ-S2)/Fe2(μ-S)2Equilibrium 90
Characterization of the p.L145F and p.S135N Mutations in SOD1: Impact on the Metabolism of Fibroblasts Derived from Amyotrophic Lateral Sclerosis Patients 88
Toward Diiron Dithiolato Biomimetics with Rotated Conformation of the [FeFe]-Hydrogenase Active Site: A DFT Case Study on Electron-Rich, Isocyanide-Based Scaffolds 84
Insights into the two-electron reductive process of [FeFe]H2ase biomimetics. Cyclic voltammetry and DFT investigation on chelates control of redox properties of [Fe2(CO)4(κ2-chelate)(µ-dithiolate)] 81
DFT investigation of binding and redox properties of the Hox redox state of [FeFe]-hydrogenases 80
CO substitution by PPh3in Fe2S2(CO)6proceeds via a novel Fe2S intermediate 79
Mechanism of Hydrogen Sulfide-Dependent Inhibition of FeFe Hydrogenase 69
Geometrical influence on the non-biomimetic heterolytic splitting of H2 by bio-inspired [FeFe]-hydrogenase complexes: a rare example of inverted frustrated Lewis pair based reactivity 54
Machine Learning for Efficient Prediction of Protein Redox Potential: The Flavoproteins Case 54
Comparison of H2 oxidation in [FeFe]-hydrogenases and biomimetic models highlights key stereoelectronic features for catalysis 52
Exome Sequencing in an ADSHE Family: VUS Identification and Limits 51
Recent Theoretical Insights into the Oxidative Degradation of Biopolymers and Plastics by Metalloenzymes 50
DFT study of CO2 activation promoted by a class of thiolate-bridged di-iron complexes with a [Cp*Fe(μ-SR)2FeCp*] scaffold 44
Beyond the iron-dithiolate mimic paradigm: new insight into the mechanism of electrocatalytic H2 production with mu-carbyne diiron complexes. 42
A De Novo-Designed Type 3 Copper Protein Tunes Catechol Substrate Recognition and Reactivity 41
Oxidation of Phospholipids by OH Radical Coordinated to Copper Amyloid-β Peptide—A Density Functional Theory Modeling 40
Superoxide Reduction by Cu-Amyloid Beta Peptide Complexes: A Density Functional Theory Study 39
Activation of the N2 molecule by means of low-valence complexes of calcium and magnesium 35
H2 oxidation and proton reduction in [FeFe]-hydrogenase biomimetics: looking backwards and forwards for new synthetic mimics. The DFT viewpoint 35
Assessing the Performance of Non-Equilibrium Thermodynamic Integration in Flavodoxin Redox Potential Estimation 34
Challenges in the Synthesis of Active Site Mimics for [NiFe]-Hydrogenases 34
H2 oxidation and proton reduction in [FeFe]-hydrogenase biomimetics: looking backwards and forwards for new synthetic mimics. The DFT viewpoint 31
Adaptation of the endemic coronaviruses HCoV-OC43 and HCoV-229E to the human host 30
Insights into Triazolylidene Ligands Behaviour at a Di-Iron Site Related to [FeFe]-Hydrogenases 26
Selective events at individual sites underlie the evolution of monkeypox virus clades 22
Homology-based classification of accessory proteins in coronavirus genomes uncovers extremely dynamic evolution of gene content 21
Normal vs. Inverted Ordering of Reduction Potentials in [FeFe]-Hydrogenases Biomimetics: Effect of the Dithiolate Bulk 20
Dating the Emergence of Human Endemic Coronaviruses 16
C-Cl Bond Activation at Rotated vs Unrotated Dinuclear Site Related to [FeFe]-Hydrogenases 12
Use of the Asymmetrical Chelating N-Donor 2-Imino-Pyridine as a Redox [Fe4S4] Cubane Surrogate at a Di-Iron Site Related to [FeFe]-Hydrogenases 12
Synthesis, Spectroscopy, and Structure of [FeRu(μ-dithiolate)(CN)2(CO)4]2- 11
Oxidative degradation of polyethylene by two novel laccase-like multicopper oxidases from Rhodococcus opacus R7 7
Totale 7.192
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Categoria #
all - tutte 21.669
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 21.669
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2018/2019203 0 0 0 0 0 0 0 0 0 55 60 88
2019/2020829 83 42 30 50 77 102 132 69 56 95 60 33
2020/20211.417 53 32 85 108 142 155 94 170 131 137 118 192
2021/20221.097 117 177 100 111 81 108 68 49 42 37 80 127
2022/20231.544 159 316 167 178 107 237 60 79 115 28 69 29
2023/20241.083 53 38 64 112 153 278 211 61 75 38 0 0
Totale 7.192