Distribuzione geografica
Continente #
NA - Nord America 9.728
EU - Europa 5.008
AS - Asia 1.392
AF - Africa 11
OC - Oceania 11
SA - Sud America 10
Continente sconosciuto - Info sul continente non disponibili 5
Totale 16.165
Nazione #
US - Stati Uniti d'America 9.522
IT - Italia 1.148
DE - Germania 915
CN - Cina 730
SE - Svezia 720
IE - Irlanda 513
UA - Ucraina 419
GB - Regno Unito 366
VN - Vietnam 270
PL - Polonia 263
HK - Hong Kong 211
CA - Canada 205
FR - Francia 153
AT - Austria 133
FI - Finlandia 104
RU - Federazione Russa 77
DK - Danimarca 72
TR - Turchia 72
IN - India 70
NL - Olanda 54
BE - Belgio 30
JP - Giappone 11
IR - Iran 10
NO - Norvegia 9
AU - Australia 8
EG - Egitto 8
ES - Italia 8
BR - Brasile 7
RO - Romania 7
TW - Taiwan 5
CH - Svizzera 4
EU - Europa 4
GR - Grecia 3
HU - Ungheria 3
IL - Israele 3
NZ - Nuova Zelanda 3
AE - Emirati Arabi Uniti 2
AR - Argentina 2
CZ - Repubblica Ceca 2
LB - Libano 2
RS - Serbia 2
SC - Seychelles 2
A1 - Anonimo 1
BA - Bosnia-Erzegovina 1
ID - Indonesia 1
IQ - Iraq 1
KW - Kuwait 1
MK - Macedonia 1
MN - Mongolia 1
MX - Messico 1
MY - Malesia 1
PE - Perù 1
PT - Portogallo 1
SG - Singapore 1
ZA - Sudafrica 1
Totale 16.165
Città #
Ann Arbor 2.187
Woodbridge 1.028
Fairfield 873
Wilmington 804
Houston 606
Chandler 548
Ashburn 498
Frankfurt am Main 497
Dublin 488
Jacksonville 455
Milan 406
Seattle 328
Dearborn 298
Cambridge 295
Kraków 258
Princeton 220
Hong Kong 207
New York 205
Dong Ket 160
Nanjing 136
Vienna 129
Lawrence 98
Shanghai 96
Altamura 87
Fremont 77
Lachine 75
Beijing 68
Guangzhou 65
Ottawa 64
San Diego 63
Shenyang 47
Toronto 45
Nanchang 44
Boardman 43
Falls Church 34
Hebei 34
Rome 33
Jinan 32
Andover 29
Brussels 29
Tianjin 25
Helsinki 23
London 23
Hangzhou 21
Jiaxing 21
Changsha 20
Mountain View 20
Grafing 19
Ningbo 18
Norwalk 18
Philadelphia 18
Leawood 17
Hefei 16
Sanayi 16
Huizen 15
San Mateo 15
Zhengzhou 15
Los Angeles 11
Nürnberg 11
Edmonton 10
Pune 10
Sesto San Giovanni 10
Kiev 9
Kocaeli 9
Monmouth Junction 9
Paris 9
Taizhou 9
Washington 9
Auburn Hills 8
Bergen 8
Capralba 8
Como 8
Fasano 8
Kunming 8
Pavia 8
Pioltello 8
Bergamo 7
Chicago 7
Modena 7
Montréal 7
Napoli 7
Parma 7
Sacramento 7
Tappahannock 7
Vimercate 7
Detroit 6
Marseille 6
Novate Milanese 6
Ardabil 5
Barcelona 5
Desio 5
Fuzhou 5
Genoa 5
Palermo 5
Radomsko 5
Taipei 5
Cerea 4
Chengdu 4
Düren 4
Hounslow 4
Totale 12.316
Nome #
DNA binding modes influence Rap1 activity in the regulation of telomere length and MRX functions at DNA ends 374
The MRX complex regulates Exo1 resection activity by altering DNA end structure 365
The ATP-bound conformation of the Mre11-Rad50 complex is essential for Tel1/ATM activation 346
Theoretical study of hydration of cyanamide and carbodiimide 320
Structurally distinct Mre11 domains mediate MRX functions in resection, end-tethering and DNA damage resistance 312
On the reactivity of the most efficient iron-based catalyst for CO2 hydrogenation: a DFT picture 266
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
Structural characterization of the nitrogenase molybdenum-iron protein with the substrate acetylene trapped near the active site 221
On the photochemistry of Fe2(edt)(CO)4(PMe3)2, a [FeFe]-hydrogenase model: A DFT/TDDFT investigation 215
Straightforward synthesis of novel Akt inhibitors based on a glucose scaffold 209
Towards hydrophobic carminic acid derivatives and their incorporation in polyacrylates 206
A theoretical study of spin states in Ni-S-4 complexes and models of the [NiFe] hydrogenase active site 198
Noncompetitive allosteric inhibitors of the inflammatory chemokine receptors CXCR1 and CXCR2: Prevention of reperfusion injury 196
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
DFT investigation of H-2 activation by [M(NHPnPr(3))(' S3 ')] (M = Ni, Pd). Insight into key factors relevant to the design of hydrogenase functional models 189
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
Computational approaches to shed light on molecular mechanisms in biological processes 176
Density functional study of structural and electronic properties of bimetallic silver-gold clusters: Comparison with pure gold and silver clusters 175
Copper coordination to the putative cell binding site of angiogenin: a DFT investigation 175
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
The Importance of Stereochemically Active Lone Pairs For Influencing PbII and AsIII Protein Binding 173
Dissecting the intimate mechanism of cyanation of {2Fe3S} complexes related to the active site of all-iron hydrogenases by DFT analysis of energetics, transition states, intermediates and products in the carbonyl substitution pathway 173
Quantum Mechanical Models of the Resting State of the Vanadium-Dependent Haloperoxidase 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
Chelate control of diiron(I) dithiolates relevant to the [Fe-Fe]-hydrogenase active site 168
Effect of Pyramidalization of the M2(SR)2 Center: The Case of (C5H5)2Ni2(SR)2 168
Mechanistic analysis of nucleophilic substrates oxidation by functional models of vanadium-dependent haloperoxidases: A density functional theory study 167
DFT investigations of models related to the active site of [NiFe] and [Fe] hydrogenases 167
A sterically stabilized FeI-FeI semi-rotated conformation of [FeFe] hydrogenase subsite model 167
Speciation of Copper–Peptide Complexes in Water Solution Using DFTB and DFT Approaches: Case of the [Cu(HGGG)(Py)] Complex 165
Functional and structural insights into the MRX/MRN complex, a key player in recognition and repair of DNA double-strand breaks 164
Electron-Rich, Diiron Bis(monothiolato) Carbonyls: C-S Bond Homolysis in a Mixed Valence Diiron Dithiolate 164
Insights into the mechanism of electrocatalytic hydrogen evolution mediated by Fe2(S2C3H6)(CO)6: The simplest functional model of the Fe-hydrogenase active site 163
Evidence for the Formation of a Mo-H Intermediate in the Catalytic Cycle of Formate Dehydrogenase 163
Molecular insight into substrate recognition by human cytosolic sialidase NEU2 163
Quantum mechanical methods for the investigation of metalloproteins and related bioinorganic compounds 159
Imine-Centered Reactions in Imino-Phosphine Complexes of Iron Carbonyls 158
New fei-fei complex featuring a rotated conformation related to [2fe]h subsite of the [fe-fe] hydrogenase 157
A diferrous dithiolate as a model of the elusive h ox inact state of the [FeFe] hydrogenases: An electrochemical and theoretical dissection of its redox chemistry. 156
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
Protein engineering for the improvement of enzymatic activity: a site-specific mutagenesis of a lactate dehydrogenase (LDH) expressed in Saccharomyces cerevisiae 153
2-Arylpropionic CXC Chemokine Receptor 1 (CXCR1) Ligands as Novel Noncompetitive CXCL8 Inhibitors 153
Excited State Properties of Diiron Dithiolate Hydrides: Implications in the Unsensitized Photocatalysis of H2 Evolution 151
Diferrous cyanides as models for the Fe-only hydrogenases 151
Quantum Chemistry serving biotechnologies: the interesting case of metalloenzyme active sites 151
A DFT investigation on structural and redox properties of a synthetic Fe6S6 assembly closely related to the [FeFe]-hydrogenases active site 150
Bromoperoxidase activity of amavadin dissected: a DFT investigation 150
The reactions of pyridinyl thioesters with triiron dodecacarbonyl: their novel diiron carbonyl complexes and mechanistic investigations 149
Computational investigation of proton reduction in [Fe-Fe]-hydrogenase bioinspired complexes: μ-H versus t-H 148
Unveiling How Stereoelectronic Factors Affect Kinetics and Thermodynamics of Protonation Regiochemistry in [FeFe] Hydrogenase Synthetic Models: A DFT Investigation 146
Unsensitized Photochemical Hydrogen Production Catalyzed by Diiron Hydrides 146
A practical synthesis of 7-azaindolylcarboxy-endo-tropanamide (DF 1012) 145
On the generation of OH· radical species from H2O2 by Cu(I) amyloid beta peptide model complexes: A DFT investigation 143
Silicon-Heteroaromatic [FeFe] Hydrogenase Model Complexes: Insight into Protonation, Electrochemical Properties, and Molecular Structures 140
Influence of the Dithiolate Bridge on the Oxidative Processes of Diiron Models Related to the Active Site of [FeFe] Hydrogenases 139
Lewis vs. Bronsted-basicities of diiron dithiolates: spectroscopic detection of the "rotated structure'' and remarkable effects of ethane- vs. propanedithiolate 139
Synthetic Designs and Structural Investigations of Biomimetic Ni-Fe Thiolates 138
Photocatalytic Hydrogen Evolution Driven by [FeFe] Hydrogenase Models Tethered to Fluorene and Silafluorene Sensitizers 137
Contrasting Protonation Behavior of Diphosphido vs Dithiolato Diiron(I) Carbonyl Complexes 134
Insight into the Catalytic Mechanism of Vanadium Haloperoxidases. DFT Investigation of Vanadium Cofactor Reactivity 132
Redox and structural properties of mixed-valence models for the active site of the [FeFe]-hydrogenase: Progress and challenges 129
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
Crystallographic Characterization of a Fully Rotated, Basic Diiron Dithiolate: Model for the H-red State? 126
Reductive Behavior of [Fe2(CO)4(κ2-dmpe){μ-(SCH2)2NBn}]: Effect of Symmetrization on the Rotated Conformation in FeI-FeI Models of [2Fe]H Subsite of [Fe-Fe]­H2ases 125
Proton Reduction and Dihydrogen Oxidation on Models of the [2Fe]H Cluster of [Fe]-Hydrogenases. A DFT Investigation. 124
Isomerization of the hydride complexes [HFe2(SR)2(PR3)x(CO)6-x]+ (x = 2, 3, 4) relevant to the active site models for the [FeFe]-hydrogenases 124
Glycine- and sarcosine-based models of vanadate-dependent haloperoxidases in sulfoxygenation reactions 122
Ligand vs. Metal Protonation of an Iron Hydrogenase Active Site Mimic 122
Influence of the basicity of internal bases in diiron model complexes on hydrides formation and their transformation into protonated diiron hexacarbonyl 115
Diiron Dithiolato Carbonyls Related to the HoxCO State of [FeFe]-Hydrogenase 113
Lactate production yield from engineered yeasts is dependent from the host background, the lactate dehydrogenase source and the lactate export 111
Comparison of H2 oxidation in [FeFe]-hydrogenases and biomimetic models highlights key stereoelectronic features for catalysis. 108
New Reactions of Terminal Hydrides on a Diiron Dithiolate 104
Electrochemical and Theoretical Studies of the Impact of the Chelating Ligand on the Reactivity of [Fe-2(CO)(4)(kappa(2)-LL)(mu-pdt)](+) Complexes with Different Substrates (LL = I-Me-CH2-I-Me, dppe; I-Me=1-Methylimidazol-2-ylidene) 103
Quantum Chemical Investigations of Reaction Paths of Metalloenzymes and Biomimetic Models – The Hydrogenase Example 103
Terminal vs Bridging Hydrides of Diiron Dithiolates: Prototonation of Fe2(dithiolate) (CO)2(PMe3)4 103
Oxidatively Induced Reactivity of [Fe-2(CO)(4)(kappa(2)-dppe)(mu-pdt)]: an Electrochemical and Theoretical Study of the Structure Change and Ligand Binding Processes 103
Reactivity of Peroxo Forms of the Vanadium Haloperoxidase Cofactor. A DFT investigations 100
Desymmetrized diiron azadithiolato, carbonyls: A step toward modeling the iron-only hydrogenases 100
DFT characterization of key intermediates in thiols oxidation catalyzed by amavadin 100
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
Investigation on the protonation of a trisubstituted [Fe2(CO)3(PPh3)(κ2-Phen)(µ-pdt)] complex related to [2Fe]H subsite of the [FeFe]H2ase 96
Electrochemical and Theoretical Investigations of the Role of the Appended Base on the Reduction of Protons by [Fe-2(CO)(4)(kappa(2)-PNPR)(mu-S(CH2)(3)S] (PNPR={Ph2PCH2}(2)NR, R=Me, Ph) 95
DFT characterization of the reaction pathways for terminal- to mu-hydride isomerisation in synthetic models of the [FeFe]-hydrogenase active site 94
Functional effects on the TDDFT investigations in organometallic photochemistry 94
DFT investigation of the stereoelectronic factors for efficient H binding and cleavage in the active site of [NiFe]-hydrogenases 93
Stereochemistry of electrophilic attack at 34e(-) dimetallic complexes: the case of diiron dithiolato carbonyls plus MeS+ 92
In-silico Modeling of [FeFe]-hydrogenase chemistry 92
Hydrogenases: Theoretical Investigations Toward Bioinspired H2 Production and Activation 91
[FeFe]-hydrogenase models and hydrogen: Oxidative addition of dihydrogen and silanes 90
Totale 15.842
Categoria #
all - tutte 44.107
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 44.107

Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2018/2019831 0 0 0 0 0 0 0 0 0 173 303 355
2019/20203.091 351 152 182 226 280 360 500 222 271 262 204 81
2020/20212.926 235 107 230 275 236 243 206 239 219 349 165 422
2021/20221.905 181 258 259 155 93 183 123 127 74 72 149 231
2022/20232.533 329 727 253 245 171 358 34 123 148 23 90 32
2023/20241.474 55 45 86 101 209 418 330 95 115 20 0 0
Totale 16.748