IRIS
TOSCANO, Marirosa
 Distribuzione geografica
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Continente #
NA - Nord America 6.381
EU - Europa 3.800
AS - Asia 687
AF - Africa 96
OC - Oceania 15
SA - Sud America 15
Continente sconosciuto - Info sul continente non disponibili 13
Totale 11.007
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Nazione #
US - Stati Uniti d'America 6.191
UA - Ucraina 1.828
DE - Germania 1.020
SE - Svezia 388
CN - Cina 328
TR - Turchia 287
CA - Canada 188
IT - Italia 159
AT - Austria 135
SN - Senegal 94
FI - Finlandia 69
RO - Romania 68
GB - Regno Unito 45
NL - Olanda 28
BE - Belgio 23
HK - Hong Kong 21
SG - Singapore 16
AU - Australia 15
FR - Francia 14
EU - Europa 13
IN - India 10
KR - Corea 10
BR - Brasile 7
PL - Polonia 4
RU - Federazione Russa 4
CL - Cile 3
IE - Irlanda 3
IR - Iran 3
SA - Arabia Saudita 3
AR - Argentina 2
CH - Svizzera 2
ID - Indonesia 2
JP - Giappone 2
PE - Perù 2
AM - Armenia 1
AZ - Azerbaigian 1
BG - Bulgaria 1
BO - Bolivia 1
BY - Bielorussia 1
ES - Italia 1
GR - Grecia 1
HR - Croazia 1
HU - Ungheria 1
IL - Israele 1
LU - Lussemburgo 1
MK - Macedonia 1
MX - Messico 1
NG - Nigeria 1
PA - Panama 1
PT - Portogallo 1
RS - Serbia 1
SL - Sierra Leone 1
TH - Thailandia 1
VN - Vietnam 1
Totale 11.007
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Città #
Jacksonville 1.278
Chandler 1.202
Dearborn 640
San Mateo 470
Roxbury 269
Lawrence 267
Izmir 260
Des Moines 167
Ottawa 159
New York 128
Vienna 121
Bremen 101
Ogden 95
Dakar 94
Shanghai 93
Grafing 92
Ann Arbor 91
Beijing 90
Wilmington 80
Helsinki 69
Ashburn 67
Inglewood 60
Boardman 55
Florence 46
Brooklyn 43
Cambridge 38
Rende 34
San Francisco 34
Toronto 26
Brussels 23
Jinan 22
Nanjing 18
Kocaeli 17
Woodbridge 17
Los Angeles 16
Hong Kong 14
Houston 13
Monmouth Junction 12
Nanchang 12
Leawood 11
Seattle 11
Seoul 10
Hefei 9
London 9
Shenyang 9
Frankfurt am Main 8
Ningbo 8
Norwalk 8
Redmond 8
Chicago 7
Pune 7
Zhengzhou 7
Augusta 6
Melbourne 6
Palermo 6
Taizhou 6
Andover 5
Bologna 5
Changsha 5
Hangzhou 5
Jiaxing 5
Redwood City 5
Sydney 5
Berlin 4
Canberra 4
Catania 4
Cosenza 4
Kilburn 4
Pozzuoli 4
Rome 4
Singapore 4
Strasbourg 4
Tianjin 4
Warsaw 4
West Jordan 4
Amsterdam 3
Charlotte 3
Duncan 3
Haikou 3
Hebei 3
Kunming 3
Lanzhou 3
Mentana 3
Milan 3
Riyadh 3
São Paulo 3
Wuhan 3
Ardabil 2
Baotou 2
Chiaravalle Centrale 2
Cinisello Balsamo 2
Dekalb 2
Fairfield 2
Falkenstein 2
Falls Church 2
Gallipoli 2
Graz 2
Guangzhou 2
Lima 2
Montreal 2
Totale 6.614
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Nome #
Density functional determination of energetics of formation of trans stilbene catalyzed by sulfenate anion 114
TEORIA DEL FUNZIONALE DELLA DENSITÀ E TERAPIA FOTODINAMICA: UN MATRIMONIO PROMETTENTE 92
Antioxidant properties of several coumarin– chalcone hybrids from theoretical insights 83
Anion-π weak interactions in a heteroaromatic calixarene receptor. A theoretical investigation 81
Theoretical Investigation of the Action Mechanisms of N,N-Di-Alkylated Diarylamine Antioxidants. 77
A density functional study of borane and alane monoammoniate (BH3NH3, AlH3NH3) 75
A non empirical and an MNDO study of N-Methyl-N'-Nitro-N-Nitrosoguanidine 74
A promising marriage between theory and experiment : density functional method versus mass spectrometry 74
The ability of a zinc pyrrolidine complex to catalyze the synthesis of cyclic carbonates from carbon dioxide and epoxides: a mechanistic theoretical investigation 74
A theoretical study on tautomerization processes of dehydrated and monohydrated cytosine 73
Applicazione della spettroscopia NMR allo studio dei fenomeni di superficie 70
Antioxidant properties of the Vam3 derivative of resveratrol 69
Antioxidant properties of phenolic compounds: H-atom versus electron transfer mechanism 68
Adsorption of H2O and H2S on the (100) surface of silicon. A theoretical study 68
Excitation energies, singlet–triplet energy gaps, spin–orbit matrix elements and heavy atom effects in BOIMPYs as possible photosensitizers for photodynamic therapy: a computational investigation 68
A theoretical study on tautomerization process of dehydrated and monohydrated cytosine 66
A Comparative Study of the Catalytic Mechanisms of the Zinc and Cadmium Containing Carbonic Anhydrase 66
A theoretical study on the protonation of nucleic acid pyrimidine and purine bases 66
Quantum mechanical DFT elucidation of CO2catalytic conversion mechanisms: Three examples 66
A comparative study of the antioxidant power of flavonoid catechin and its planar analogue 65
A non empirical cluster model study of relaxation of the (111) surface of C, Si, Ge 65
A theoretical study of NO-graphite system 63
On the Electrochromic Properties of Borepins: A Computational Prediction 63
Density Functional Predictions of Antioxidant Activity and UV Spectral Features of Nasutin A, Isonasutin, Ellagic Acid, and One of Its Possible Derivatives 61
A theoretical study of relaxation and reconstruction of the (111) surface of diamond 61
A density functional study of oxo-hydroxy tautomerism of 5-fluorouracil 61
On the interaction of halogen atoms with (111) and (100) surfaces of silicon 60
Conformational behaviour of isomeric bithienyls. An ab initio study 60
"Density functional theory as a tool for the prediction of the properties in molecules with biological and pharmacological significance" 60
Molecular mechanics and dynamic of a- and b -amanitin 59
A theoretical study of the NO-C10H8 system as a model for the NO-graphite interaction 59
Reaction Mechanism of Low-Spin Iron(III)- and Cobalt(III)-Containing Nitrile Hydratases: A Quantum Mechanics Investigation 59
Can BODIPY Dimers Act as Photosensitizers in Photodynamic Therapy? A Theoretical Prediction 58
A non empirical study of the conformational behaviour and molecular structure of nicotamide 57
Potential Energy Surfaces for the Gas-Phase Interaction between α-Alanine and Alkali Metal Ions (Li+, Na+, K+). A Density Functional Study 56
Time-Dependent Density Functional Computations of the Spectrochemical Properties of Dithiolodithiole and Thiophene Electrochromic Systems 56
''Geometrical structure, dipole moments, ionizational potentials and vibrational frequences of CH2 and halocarbenes 55
Adsorption of CO on model clusters simulating the Ni(100) surface, studied by means of the LCGTO-LSD method 55
A Proposal for Mitochondrial Processing Peptidase Catalytic Mechanism 54
Computational investigation on the Mechanism of amide bond formation by using phosphine-based redox catalysis 54
Cluster model study of the chemisorption of atoms and molecules on the basal plane of graphite 53
Structure, conformation and electronic properties of apigenin, luteolin and taxifolin antioxidants. A first principle theoretical study 53
Antioxidant Properties Comparative Study of Natural Hydroxycinnamic Acids and Structurally Modified Derivatives: Computational Insights 53
Tri-Esterase and Promiscuous Di-Esterase Activities of a di-Co(II)containing Organo-Phosphate Degrading Enzyme Reaction Mechanisms 53
Computational mechanistic insights on the NO oxidation reaction catalyzed by non-heme biomimetic Cr-N-tetramethylated cyclam complexes 53
Interaction of the Mn2+, Co2+, Ni2+, and Zn2+ with Prion Protein HGGGW Pentapeptide Model 52
Acceptor ability and donor strength of biphenyl-like-a diimine ligands. A theoretical and gas-phase UV photoelectron spectroscopic study 52
''Geometric and electronic structure of ground and excited states of group VA diatomica. A theoretical LCGTO-MP-LSD study 52
Photophysical properties of nitrated and halogenated phosphorus tritolylcorrole complexes: Insights from theory 52
Theoretical evaluation of quadrupole moments by using gaussian density functional method 51
Conformation and structure of ethane-1,2-dithiol from ab-initio HF and MP3 study 51
“A comparative study of the catalyric mechanisms of zinc and cadmium carbonic anhidrase” 50
Conformational behaviour of aromatic systems. part. X. Isomeric phenyl-pyrrole 50
The fragmentation of C2H6N+ ions: An Alternative mechanism 50
Computational Investigation of the Influence of Halogen Atoms on the Photophysical Properties of Tetraphenylporphyrin and Its Zinc(II) Complexes 50
Interaction of Cu+ and Cu2+ ions with a-alanine. A density functional study 49
Catalytic mechanism of the arylsulfatase promiscuous enzyme from Pseudomonas aeruginosa 49
Structural and Binding Properties of Metal Ion Chelators Relevant to Alzheimer’s Disease. A Theoretical Investigation 49
Proton affinity and protonation sites of aniline. Energetic behavior and density functional reactivity indices 48
Catalytic activity of a æ-class zinc and cadmium containing carbonic anhydrase. Compared work mechanisms 48
Establishing the Catalytic Mechanism of Human Pancreatic α-Amylase with QM/MM Methods 48
Absolute proton affinities and gas-phase basicities of nitrogen containing compounds. A gaussian density functional study 48
Hydrogen chemisorption on the Ni(100) surface:electronic and magnetic properties from a local spin density study 47
Density Functional computations of the energetic and spectroscopic parameters of quercetin and its radicals in the gas phase and in solvent 47
Theoretical study of molecular and dissociative adsorption of ethylene on silicon and germanium (100) surfaces 47
The performance of density functional based methods in the description of selected biological systems and processes 47
Singlet-triplt gap in HCl halocarbene 47
Fragmentation of [C2H6N]+ ion: an alternative mechanism 47
Density functional study of the antioxidant activity of some recently synthesized resveratrol analogues 47
The role of glutathione in cadmium ion detoxi.cation: Coordination modes and binding properties – A density functional study 47
Model clusters and electronic characteristics of deep-level impurities in silicon 46
Hydrogen chemisorption on the Ni(100) surfaces: Electronic and magnetic properties from a local spin density study 46
The structure of ammonia-boryl radical [BH2NH3], an inorganic analogue of the ethyl radical. A non empirical study 46
Interaction of carbon atoms with the basal plane of graphite. A theoretical study of the chemisorption on model finite cluster compounds 46
The interactions of Al and Al+ with water: Potential energy surface for the dehydrogenation reaction 46
The effects of the metal ion substitution into the active site of metalloenzymes: A theoretical insight on some selected cases 46
Density functional computations of proton affinity and gas-phase basicity of proline 45
Electronic structure and photoelectron spectra for Sb2 and Sb4 from LSD calculations.Model potential for Sb 45
Calculation of proton affinities and absolute gas-phase basicities of X3 group VI triatomics. A density functional study 45
Molecular quadrupole moments 45
"Working Mechanism of Insulin-Degrading Enzyme" 45
Continuum dielectric models for the solvent and density functional theory: the state-of-the-art 45
Gaussian density functional study for small neutral (Aln), positive (Aln+) and negative (Aln-)aluminium clustera (n= 2-5) 45
Molecular mechanics and dynamics of a- and b-amanitin 45
Antioxidant properties and free radical scavenging mechanisms of cyclocurcumin 45
Density functional study of oxo-hydroxy tautomerism of 5-fluorouracil 44
Theoretical investigation on DNA/RNA base pairs mediated by copper, silver, and gold cations 44
Geometric and electronic structure of ground and excited states of group VA diatomics. A theoretical LCGTO-MP-LSD study 44
Chemisorption of atomic and molecular oxygen on (100) surface of silicon. A theoretical study 44
Oenin and quercetin copigmentation: Highlights from density functional theory 44
On the interaction of bare and hydrated aluminium ion with nucleic acid bases and monophosphate nucleotides 43
Model cluster and electronic characteristic of deep-level impurities in silicon 43
Gaussian density functional study far small Aln, Aln+ and Aln- clusters 43
Theoretical study of oxygen chemisorption 0n (111) and (100) silicon surface 43
Interaction of acetylene with Si and Ge(100)surfaces. A theoretical study 43
Theoretical study of impurities in silicon:substitutional oxygen and sulfur 43
Geometrical, spectroscopic, and magnetic properties of an oxygen atom adsorbed on Ni(100) surface 43
On the Interaction between Manganese Cation (Mn2+) and the Nucleic Acid Bases (T,U,C,A,G) in the Gas Phase 43
Conformational behaviour of aromatic systems. Part X. Isomeric phenyl-pyrroles 43
Interaction of Li+, Na+, and K+ with the Proline Amino Acid. Complexation Modes, Potential Energy Profiles, and Metal Ion Affinities 43
Totale 5.486
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Categoria #
all - tutte 68.502
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 68.502
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2018/2019260 0 0 0 0 0 0 0 0 0 0 260 0
2019/20202.640 290 261 2 263 170 653 197 318 62 33 271 120
2020/20212.005 322 1 259 275 0 269 18 264 10 282 55 250
2021/20222.226 23 300 3 99 189 151 14 548 19 21 309 550
2022/20232.631 304 190 54 345 470 290 3 268 352 69 153 133
2023/2024921 173 53 105 25 48 166 30 79 164 56 22 0
Totale 11.072