IRIS
MARINO, Tiziana
 Distribuzione geografica
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Continente #
NA - Nord America 5.617
EU - Europa 2.481
AS - Asia 1.213
AF - Africa 93
SA - Sud America 40
Continente sconosciuto - Info sul continente non disponibili 11
OC - Oceania 11
Totale 9.466
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Nazione #
US - Stati Uniti d'America 4.385
CA - Canada 1.229
UA - Ucraina 970
DE - Germania 550
CN - Cina 544
SG - Singapore 440
IT - Italia 304
SE - Svezia 214
AT - Austria 191
TR - Turchia 125
SN - Senegal 85
FI - Finlandia 80
NL - Olanda 41
HK - Hong Kong 32
BR - Brasile 28
IN - India 28
BE - Belgio 23
FR - Francia 21
GB - Regno Unito 19
KR - Corea 19
CZ - Repubblica Ceca 16
RU - Federazione Russa 14
AU - Australia 11
EU - Europa 11
ES - Italia 10
PL - Polonia 10
JP - Giappone 4
PE - Perù 4
PT - Portogallo 4
RS - Serbia 4
AE - Emirati Arabi Uniti 3
AR - Argentina 3
CL - Cile 3
MA - Marocco 3
VN - Vietnam 3
CR - Costa Rica 2
ID - Indonesia 2
IL - Israele 2
LT - Lituania 2
SA - Arabia Saudita 2
ZA - Sudafrica 2
AM - Armenia 1
BG - Bulgaria 1
BO - Bolivia 1
BY - Bielorussia 1
DK - Danimarca 1
EC - Ecuador 1
EE - Estonia 1
EG - Egitto 1
HU - Ungheria 1
IR - Iran 1
JO - Giordania 1
KH - Cambogia 1
LA - Repubblica Popolare Democratica del Laos 1
LK - Sri Lanka 1
LU - Lussemburgo 1
LV - Lettonia 1
MX - Messico 1
NO - Norvegia 1
PK - Pakistan 1
SC - Seychelles 1
TH - Thailandia 1
TM - Turkmenistan 1
TN - Tunisia 1
Totale 9.466
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Città #
Montréal 1.154
Chandler 820
Jacksonville 608
Boardman 404
San Mateo 323
Singapore 319
Dearborn 316
Vienna 164
Roxbury 149
Shanghai 146
Lawrence 143
Izmir 115
New York 114
Ashburn 101
Des Moines 95
Dakar 85
Helsinki 80
Rende 78
Ann Arbor 64
Beijing 62
Bremen 57
Ogden 57
Ottawa 56
Wilmington 52
Brooklyn 50
Inglewood 38
Florence 37
Guangzhou 29
Hong Kong 29
San Francisco 29
Grafing 26
Cosenza 25
Brussels 23
Cambridge 23
Wuhan 21
Munich 20
Los Angeles 19
Seoul 19
Falkenstein 17
Seattle 17
Brno 15
Nanjing 15
Pune 15
Toronto 15
Jiaxing 14
Houston 13
Jinan 13
West Jordan 11
Frankfurt am Main 10
Milan 10
Redwood City 10
Rome 10
Santa Clara 10
Shenzhen 10
Zhengzhou 10
Hefei 8
Nanchang 8
Wroclaw 8
Chicago 7
Catania 6
Secaucus 6
São Paulo 6
Woodbridge 6
Wuxi 6
Amsterdam 5
Jinhua 5
Kunming 5
London 5
Melbourne 5
Monmouth Junction 5
Belgrade 4
Coimbatore 4
Lima 4
Messina 4
Palermo 4
Pozzuoli 4
Quanzhou 4
Stockholm 4
Strasbourg 4
Alquerias del Nino Perdido 3
Andover 3
Berlin 3
Burjassot 3
Canberra 3
Carmiano 3
Catanzaro 3
Changping 3
Chizhou 3
Duncan 3
Genova 3
Haikou 3
Heze 3
Ho Chi Minh City 3
Lanzhou 3
Naples 3
Paris 3
Pushchino 3
Redmond 3
Shenyang 3
Sydney 3
Totale 6.355
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Nome #
Insights into the Catalytic Mechanism of Domains CD1 and CD2 in Histone Deacetylase 6 from Quantum Calculations 1.214
Insight on the chelation of aluminum(III) and iron(III) by curcumin in aqueous solution 106
Aluminum(III), iron(III) and copper(II) complexes of luteolin: stability, antioxidant and anti-inflammatory properties 106
The antioxidant capability of higenamine: Insights from theory 104
TEORIA DEL FUNZIONALE DELLA DENSITÀ E TERAPIA FOTODINAMICA: UN MATRIMONIO PROMETTENTE 99
On the Catalytic Activity of the Engineered Coiled-Coil Heptamer Mimicking the Hydrolase Enzymes: Insights from a Computational Study 98
Can Expanded Bacteriochlorins Act as Photosensitizers in Photodynamic Therapy? Good News from Density Functional Theory Computations 91
Effect of Copper on the Mitochondrial Carnitine/Acylcarnitine Carrier Via Interaction with Cys136 and Cys155. Possible Implications in Pathophysiology 90
A DFT investigation of a bulky biomimetic model catalyzing the 5′-outer ring deiodination of thyroxine 88
Antioxidant properties of the Vam3 derivative of resveratrol 88
A theoretical study on tautomerization processes of dehydrated and monohydrated cytosine 83
A promising marriage between theory and experiment : density functional method versus mass spectrometry 82
Can Fused Thiophene-Pyrrole Containing Rings act as Possible New Electrochromic Dyes ? A Computational Prediction 81
The ability of a zinc pyrrolidine complex to catalyze the synthesis of cyclic carbonates from carbon dioxide and epoxides: a mechanistic theoretical investigation 79
Antioxidant properties of phenolic compounds: H-atom versus electron transfer mechanism 78
A Comparative Study of the Catalytic Mechanisms of the Zinc and Cadmium Containing Carbonic Anhydrase 78
"Photophysical origin of the reduced photodynamic therapy activity of temocene compared to Foscan®: Insights from theory" 78
A theoretical study on tautomerization process of dehydrated and monohydrated cytosine 77
Complexation behaviour of caffeic, ferulic and p-coumaric acids towards aluminium cation: a combined experimental and theoretical approach 77
Chemical Insights intothe AntioxidantMechanismsofAlkylseleno and Alkyltelluro Phenols:Periodic Relatives Behaving Differently 77
A Review on Coordination Properties of Al(III) and Fe(III) toward Natural Antioxidant Molecules: Experimental and Theoretical Insights 76
Quantum mechanical DFT elucidation of CO2catalytic conversion mechanisms: Three examples 73
"Density functional theory as a tool for the prediction of the properties in molecules with biological and pharmacological significance" 72
A Detailed Investigation on the Catalytic Mechanism of Fe(III)-Zn(II) Purple Acid Phosphatase 72
Attosecond dynamics simulations of glycine irradiated by α-particle: Comment on “A never-ending story in the sky: The secrets of chemical evolution” by C. Puzzarini and V. Barone 71
Photophysical properties of free and metallated meso-substituted tetrabenzotriazaporphyrin from density functional theory investigation 70
Hydrolase–like catalysis and structural resolution of natural products by a metal–organic framework 70
Potential Energy Surfaces for the Gas-Phase Interaction between α-Alanine and Alkali Metal Ions (Li+, Na+, K+). A Density Functional Study 69
On the Electrochromic Properties of Borepins: A Computational Prediction 69
Assessment of Approximate Density Functional Methods for the Study of the Interactions of Al(III) with Aromatic Amino Acids 69
" The conformational properties of (-)-Dolastatin 10, A powerful Antineoplastic Agent" 68
Reaction Mechanism of Low-Spin Iron(III)- and Cobalt(III)-Containing Nitrile Hydratases: A Quantum Mechanics Investigation 68
Molecular mechanics and dynamic of a- and b -amanitin 65
How can work methanol dehydrogenase from Methylacidiphilum fumariolicum with the alien Ce(III) ion in the active center? A theoretical study 65
" Conformational behaviour of the antineoplastic peptide dolastatin-10 and of two mutated derivatives" 64
A Proposal for Mitochondrial Processing Peptidase Catalytic Mechanism 63
Experimental and theoretical study on the coordination properties of quercetin towards aluminum(III), iron(III) and copper(II) in aqueous solution 63
Computational mechanistic insights on the NO oxidation reaction catalyzed by non-heme biomimetic Cr-N-tetramethylated cyclam complexes 63
How the lanthanide ions affect the addtion-elimination step of methanol dehydrogenases 63
Interaction of the Mn2+, Co2+, Ni2+, and Zn2+ with Prion Protein HGGGW Pentapeptide Model 61
Explicit Water Molecules Play aKey Role in the Mechanism of Rhodium-Substituted Human Carbonic Anhydrase 61
A micro-environmental study of the Zn+2–Aβ1–16 structural properties 61
Food Antioxidants: Chemical Insights at the Molecular Level 60
A deeper insight on the radical scavenger activity of two simple coumarins toward OOH radical 60
QM cluster or QM/MM in computational enzymology: The test case of LigW-decarboxylase 59
Theoretical investigation on DNA/RNA base pairs mediated by copper, silver, and gold cations 58
COMBINED MOLECULAR MECHANICS, MOLECULAR DYNAMICS AND QUANTUM MECHANICAL STUDY OF (1)-MULTIFIDENE STRUCTURE AND CONFORMATION 58
Mechanistic investigation of trimethylamine-N-oxide reduction catalysed by biomimetic molybdenum enzyme models 58
Ab Initio Study of Microsolvated Al3+−Aromatic Amino Acid Complexes 58
Insights into the coordination mode of quercetin with the Al(III) ion from a combined experimental and theoretical study 58
Interaction of Cu+ and Cu2+ ions with a-alanine. A density functional study 57
Theoretical Comparison between Structural and Dynamical Features of Dolastatins 11 and 12 Antineoplastic Depsipeptides 57
"Working Mechanism of Insulin-Degrading Enzyme" 57
The Hydration of Aromatic Nitriles Catalyzed by Mn-OH Complexes: a Rationalization from Quantum Chemical Investigations 57
Structural and Binding Properties of Metal Ion Chelators Relevant to Alzheimer’s Disease. A Theoretical Investigation 56
Density Functional computations of the energetic and spectroscopic parameters of quercetin and its radicals in the gas phase and in solvent 56
The role of the halogen bond in iodothyronine deiodinase: Dependence on chalcogen substitution in naphthyl-based mimetics 56
Catalytic activity of a æ-class zinc and cadmium containing carbonic anhydrase. Compared work mechanisms 55
Catalytic mechanism of the arylsulfatase promiscuous enzyme from Pseudomonas aeruginosa 55
“Structure and properties of a copper-mediated nucleobase pair from density functional theory investigation” 55
The performance of density functional based methods in the description of selected biological systems and processes 55
Probing of the tautomeric amino-oxo vs imino-oxo equilibrium of substituted deoxycytidines by fast atom bombardment mass spectrometry 55
The Catalytic Mechanism of Human Transketolase 55
Antioxidant and copper-chelating power of new molecules suggested as multiple target agents against Alzheimer's disease. A theoretical comparative study 54
Chalcogen Effects in the Photophysical Properties of Dimethylamino-1,8-naphthalimide Dyes Revealed by DFT Investigation 54
Molecular mechanics and dynamics of a- and b-amanitin 53
The role of glutathione in cadmium ion detoxi.cation: Coordination modes and binding properties – A density functional study 53
Conformational behaviour of antineoplastic peptides Dolastatin 10 and Dolastatin 15 from Monte Carlo and Molecular Dynamics simulations 52
Density functional computations of proton affinity and gas-phase basicity of proline 52
Partecipation of the Nucleobases in the Regioselective Backbone Fragmentation of Nucleic Acid. A Molecular Dynamics and Tandem Mass Spectrometric Investigation on a Model Dinucleoside Phosphotriester 52
Structural characterization of aluminium(III) and iron(III) complexes of coumarinic acid in aqueous solutions from combined experimental and theoretical investigations 52
The effects of the metal ion substitution into the active site of metalloenzymes: A theoretical insight on some selected cases 52
Density functional study of oxo-hydroxy tautomerism of 5-fluorouracil 51
Participation of the nucleobases in the regioselective backbone fragmentation of nucleic acids. A molecular dynamics and tandem mass spectrometric investigation on a model dinucleoside phosphotriester 51
Chapter 2: Computational Enzymology: A Challenge for Multiscale Approaches 51
Interaction of Li+, Na+, and K+ with the Proline Amino Acid. Complexation Modes, Potential Energy Profiles, and Metal Ion Affinities 50
Why hydroxy-proline improves the catalytic power of the peptidoglycan: N -deacetylase enzyme: Insight from theory 50
Inhibition of the carnitine acylcarnitine carrier by carbon monoxide reveals a novel mechanism of action with non-metal-containing proteins 49
Structural Characterization of Peripolin and Study of Antioxidant Activity of HMG Flavonoids from Bergamot Fruit 49
Direct Hydrogenation of Carbon Dioxide by an Artifi cial Reductase Obtained by Substituting Rhodium for Zinc in the Carbonic Anhydrase Catalytic Center. A Mechanistic Study 49
Promiscuous Ability of Human Carbonic Anhydrase: QM and QM/MM Investigation of Carbon Dioxide and Carbodiimide Hydration 49
Theoretical insight into joint photodynamic action of a gold(i) complex and a BODIPY chromophore for singlet oxygen generation 49
Site-Selective Methylation of Nβ-Nosyl Hydrazides of N-Nosyl Protected α-Amino Acids 48
Tautomeric equilibria of 2- and 4-thiouracil in gas phase and in solvent: A density functional study 47
Oxidation Mechanism of Methionine by HO• Radical: A Theoretical Study 46
TDDFT investigation on Methylviologen, 3,7-diazabenzophosphole and helical helquat electrochromic systems 46
Mechanism of Thyroxine Deiodination by Naphthyl-Based Iodothyronine Deiodinase Mimics and the Halogen Bonding Role: A DFT Investigation 46
The role of arsenic in the hydrolysis and DNA metalation processes in an arsenous acid–platinum(II) anticancer complex 46
On the interaction of rubidium and cesium mono-, strontium and barium bi- cations with DNA and RNA bases. A Theoretical study 46
Geometries and stabilities of G center dot GC, T center dot AT, an C center dot GC nucleic acid base triplets 45
DFT investigation of the mismatched base pairs (T-Hg-T)3, (U-Hg-U)3 and d(T-Hg-T)2 and d(U-Hg-U)2 45
Radical scavenging ability of gallic acid toward OH and OOH radicals. Reaction mechanism and rate constants from the density functional theory 45
The contribution of density functional theory to the atomistic knowledge of electrochromic processes 45
Potential energy surfaces of metal-ligand interactions obtained using density functional theory 44
Human Insulin-Degrading Enzyme Working Mechanism 44
Molecular dynamics, density functional and second-order Moller-Plesset theory study of the structure and conformation of acetylcholine in vacuo and in solution 44
Atomistic details of the Catalytic Mechanism of Fe(III)−Zn(II) Purple Acid Phosphatase 44
“AM1 semiempirical study of carcinogenic aromatic amines: the case of 2-amino-e-methylimidazo[4,5-f]quinoxaline (Iqx) and their methyl- and phenyl-derivatives”. 43
Complexation of Al(III) by aromatic amino acids in the gas phase 43
Peptide Hydrolysis by the Binuclear Zinc Enzyme Aminopeptidase from Aeromonas proteolytica: A Density Functional Theory Study 43
Totale 7.327
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Categoria #
all - tutte 68.140
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 68.140
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/2020511 0 0 0 0 0 0 104 162 27 28 138 52
2020/20212.200 145 3 138 147 3 141 26 137 1.174 145 20 121
2021/20221.497 10 221 5 67 121 58 8 372 16 20 214 385
2022/20231.929 187 205 61 259 288 187 7 209 234 55 122 115
2023/20241.317 151 74 90 47 59 173 46 80 107 99 56 335
2024/20251.081 209 397 63 105 110 180 17 0 0 0 0 0
Totale 9.628