Bicocca Open Archive

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GRECO, CLAUDIO
 Distribuzione geografica
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Continente #
NA - Nord America 16.397
EU - Europa 9.947
AS - Asia 9.464
SA - Sud America 1.392
AF - Africa 228
OC - Oceania 19
Continente sconosciuto - Info sul continente non disponibili 11
Totale 37.458
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Nazione #
US - Stati Uniti d'America 15.522
SG - Singapore 2.663
SE - Svezia 2.532
IT - Italia 2.489
VN - Vietnam 2.414
CN - Cina 1.864
HK - Hong Kong 1.134
BR - Brasile 1.058
DE - Germania 1.031
RU - Federazione Russa 993
CA - Canada 752
UA - Ucraina 514
IE - Irlanda 511
GB - Regno Unito 397
FR - Francia 390
PL - Polonia 325
IN - India 284
BD - Bangladesh 248
AT - Austria 158
FI - Finlandia 157
AR - Argentina 134
KR - Corea 133
ID - Indonesia 117
TR - Turchia 108
NL - Olanda 91
DK - Danimarca 87
IQ - Iraq 83
ZA - Sudafrica 78
ES - Italia 77
MX - Messico 68
JP - Giappone 62
PK - Pakistan 56
CH - Svizzera 49
CO - Colombia 45
EC - Ecuador 45
SA - Arabia Saudita 42
BE - Belgio 41
PH - Filippine 39
VE - Venezuela 34
MA - Marocco 31
UZ - Uzbekistan 31
TN - Tunisia 25
CZ - Repubblica Ceca 24
KE - Kenya 22
PY - Paraguay 22
EG - Egitto 21
CL - Cile 19
MY - Malesia 18
AU - Australia 17
LT - Lituania 17
AE - Emirati Arabi Uniti 15
JM - Giamaica 13
JO - Giordania 13
KZ - Kazakistan 13
NP - Nepal 13
OM - Oman 13
BO - Bolivia 11
PE - Perù 11
TW - Taiwan 11
AZ - Azerbaigian 10
IR - Iran 10
LB - Libano 10
RO - Romania 10
TH - Thailandia 10
ET - Etiopia 9
IL - Israele 9
UY - Uruguay 9
CR - Costa Rica 8
DO - Repubblica Dominicana 8
DZ - Algeria 8
PT - Portogallo 8
AL - Albania 7
NG - Nigeria 7
PS - Palestinian Territory 7
BG - Bulgaria 6
CI - Costa d'Avorio 6
GR - Grecia 6
EU - Europa 5
GE - Georgia 5
HN - Honduras 5
NI - Nicaragua 5
NO - Norvegia 5
SC - Seychelles 5
SV - El Salvador 5
A2 - ???statistics.table.value.countryCode.A2??? 4
AO - Angola 4
BH - Bahrain 4
GT - Guatemala 4
KW - Kuwait 4
MN - Mongolia 4
KG - Kirghizistan 3
LY - Libia 3
MD - Moldavia 3
RS - Serbia 3
SN - Senegal 3
SY - Repubblica araba siriana 3
A1 - Anonimo 2
BA - Bosnia-Erzegovina 2
BB - Barbados 2
BY - Bielorussia 2
Totale 37.418
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Città #
Ann Arbor 2.706
Stockholm 1.881
Singapore 1.527
Ashburn 1.396
Hong Kong 1.109
Milan 964
San Jose 926
Woodbridge 907
Wilmington 856
Fairfield 845
Frankfurt am Main 686
Ho Chi Minh City 676
Houston 561
Hanoi 522
Toronto 522
Dublin 492
Jacksonville 491
Chandler 456
Seattle 364
Dearborn 362
Santa Clara 354
Dallas 343
Los Angeles 331
New York 316
Cambridge 273
Kraków 265
Beijing 234
Chicago 230
Princeton 225
The Dalles 192
Nanjing 166
Hefei 162
Vienna 146
Dong Ket 139
Rome 132
Seoul 123
Lauterbourg 118
Buffalo 109
Shanghai 107
Council Bluffs 101
São Paulo 97
Altamura 95
Moscow 94
Boardman 90
Jakarta 85
Lawrence 84
Lachine 79
Da Nang 77
Guangzhou 70
Haiphong 68
Kent 56
London 56
Orem 54
San Diego 54
Fremont 53
Romola 53
Chennai 49
Columbus 48
Ha Long 48
Biên Hòa 46
Munich 45
Tokyo 45
Warsaw 45
Tianjin 44
Nanchang 43
Johannesburg 41
Montreal 41
Shenyang 41
Hebei 40
Zurich 39
Brussels 38
Denver 37
Phoenix 36
Thái Nguyên 36
Helsinki 35
Baghdad 34
Brooklyn 34
Hải Dương 34
Changsha 33
Atlanta 32
Falls Church 32
Jinan 31
Quận Bình Thạnh 31
Bắc Ninh 30
Poplar 29
Andover 28
Can Tho 27
Paris 26
Turin 26
Zhengzhou 26
Manchester 25
Rio de Janeiro 25
Tashkent 25
Belo Horizonte 24
Brasília 24
Bắc Giang 24
Edmonton 24
Ninh Bình 24
San Francisco 24
Jiaxing 23
Totale 24.972
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Nome #
A Zundel ion in the catalytic proton transfer pathway of [FeFe]-hydrogenase 1.937
Role of the carbon defects in the catalytic oxygen reduction by graphite nanoparticles: a spectromagnetic, electrochemical and computational integrated approach 571
CO oxidation mechanism of silver‐substituted Mo/Cu CO‐dehydrogenase. Analogies and differences to the native enzyme 551
The Challenging in silico Description of Carbon Monoxide Oxidation as Catalyzed by Molybdenum-Copper CO Dehydrogenase 535
Guiding Competitive Binding Assays Using Protein–Protein Interaction Prediction: The HER2–Affitin Use Case 529
A thiocarbonate sink on the enzymatic energy landscape of aerobic CO oxidation? Answers from DFT and QM/MM models of Mo–Cu CO-dehydrogenases 506
Reactivation of the Ready and Unready Oxidized States of [NiFe]-Hydrogenases: Mechanistic Insights from DFT Calculations 499
Theoretical Insights into the Aerobic Hydrogenase Activity of Molybdenum–Copper CO Dehydrogenase 482
Experimental and Theoretical Investigation on the Catalytic Generation of Environmentally Persistent Free Radicals from Benzene 476
Computational study on light emission by NanoLuc luciferase 459
The large subunit of the regulatory [NiFe]-hydrogenase from Ralstonia eutropha – A minimal hydrogenase? 457
A theoretical study on the reactivity of the Mo/Cu-containing carbon monoxide dehydrogenase with dihydrogen 450
Dynamical behavior and conformational selection mechanism of the intrinsically disordered sic1 kinase-inhibitor domain 419
Investigations of the electronic-molecular structure of bio-inorganic systems using modern methods of quantum chemistry 407
Interaction of the H-cluster of FeFe hydrogenase with halides 401
H2 Activation in [FeFe]-Hydrogenase Cofactor Versus Diiron Dithiolate Models: Factors Underlying the Catalytic Success of Nature and Implications for an Improved Biomimicry 399
Comparative analysis of Polyethylene-Degrading Laccases: Redox Properties and Enzyme-Polyethylene Interaction Mechanism. 387
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 386
Computational Insight on CO2 Fixation to Produce Styrene Carbonate Assisted by a Single-Center Aluminum(III) Catalyst and Quaternary Ammonium Salts 383
Theoretical investigation of aerobic and anaerobic oxidative inactivation of the [NiFe]-hydrogenase active site 381
Bypassing the statistical limit of singlet generation in sensitized upconversion using fluorinated conjugated systems 380
Rational Design of Fe2(μ-PR2)2(L)6 Coordination Compounds Featuring Tailored Potential Inversion 376
Theoretical and experimental investigation of UV–Vis absorption spectrum in a Eu(3+) based complex for luminescent downshifting applications 372
Shedding light on bioluminescence: a computational study on light emission by NanoLuc luciferase 371
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 370
DFT investigation of the CO2 activation at the active site of the Carbon Monoxide Dehydrogenases 369
Targeting amyloid aggregation: An overview of strategies and mechanisms 368
Organophosphorous ligands in hydrogenase-inspired iron-based catalysts: A DFT study on the energetics of metal protonation as a function of P-atom substitution 359
Theory Related to [FeFe]- and [NiFe]-hydrogenases: Stereoelectronic Properties, H-cluster Oxidation, and Mechanisms for Increasing Oxygen Tolerance 353
Towards biomimetic models of the reduced [FeFe]-hydrogenase that preserve the key structural features of the enzyme active site; A DFT investigation 349
Enlightening the reaction mechanism of furimazine oxidation in DMSO 346
Functionally relevant interplay between the Fe4S4 cluster and CN- ligands in the active site of [FeFe]-Hydrogenases 345
Mechanism of non-phenolic substrate oxidation by the fungal laccase Type 1 copper site from Trametes versicolor: the case of benzo[a]pyrene and anthracene 327
Does the environment around the H-cluster allow coordination of the pendant amine to the catalytic iron center in [FeFe] hydrogenases? Answers from theory 324
Can water act as a nucleophile in CO oxidation catalysed by Mo/Cu CO‐dehydrogenase? Answers from theory 322
Calix[4]arene-Based Sensitizers for Host-Guest Supramolecular Dyads for Solar Energy Conversion in Photoelectrochemical Cells 316
QM/MM study of the binding of H2 to MoCu CO dehydrogenase: development and applications of improved H2 van der Waals parameters 315
Theoretical Investigation of Inorganic Particulate Matter: The Case of Water Adsorption on a NaCl Particle Model Studied Using Grand Canonical Monte Carlo Simulations. 312
Catalytic H2 evolution/oxidation in [FeFe]-hydrogenase biomimetics: account from DFT on the interplay of related issues and proposed solutions 307
Theoretical Investigation of Inorganic Particulate Matter: The Case of Water Adsorption on a NaCl Particle Model Studied Using Grand Canonical Monte Carlo Simulations 304
Copper coordination to the putative cell binding site of angiogenin: a DFT investigation 304
A conserved loop in polynucleotide phosphorylase (PNPase) essential for both RNA and ADP/phosphate binding 302
Influence of the [2Fe]H subcluster environment on the properties of key intermediates in the catalytic cycle of [FeFe] hydrogenases: Hints for the rational design of synthetic catalysts 299
Unraveling the Reaction Mechanism of Mo/Cu CO Dehydrogenase Using QM/MM Calculations 299
Behind the glow: unveiling the nature of NanoLuc reactants and products 293
Theoretical insights into [NiFe]-hydrogenases oxidation resulting in a slowly reactivating inactive state 290
Genetic analysis of polynucleotide phosphorylase structure and functions 289
Partition of the Reactive Species of the Suzuki-Miyaura Reaction between Aqueous and Micellar Environments 288
Structural and electronic properties of the [FeFe] hydrogenase H-cluster in different redox and protonation states. A DFT investigation 283
The oxidative inactivation of FeFe hydrogenase reveals the flexibility of the H-cluster 283
Structural insights into the active-ready form of [FeFe]-Hydrogenase and mechanistic details of its inhibition by carbon monoxide 277
Fast generation of broken-symmetry states in a large system including multiple iron-sulfur assemblies: Investigation of QM/MM energies, clusters charges, and spin populations 273
TDDFT modelling of the CO-photolysis of Fe2(S2C3H6)(CO)6, a model of the [FeFe]-Hydrogenase catalytic site 273
Excited state properties and photochemistry in [FeFe] hydrogenase research area. The Time-Dependent Density Functional Theory theoretical picture 272
Time-dependent density functional theory study of Fe2(CO) 9 low-lying electronic excited states 268
Insights into the mechanism of electrocatalytic hydrogen evolution mediated by Fe2(S2C3H6)(CO)6: The simplest functional model of the Fe-hydrogenase active site 267
ITForge: A Generative AI-Driven Drug Discovery Pipeline for Structure-Based De Novo Drug Design and Molecular Ranking with Open-Source Frameworks 266
A QM/MM investigation of the activation and catalytic mechanism of Fe-only hydrogenases 266
Combining experimental and theoretical methods to learn about the reactivity of gas-processing metalloenzymes 266
Evaluation of docking procedures reliability in affitins-partners interactions 265
An Open-Source AI-Driven Pipeline for Structure-Based De Novo Drug Design and Ligand Prioritization: ITForge 264
Quantum mechanical methods for the investigation of metalloproteins and related bioinorganic compounds 264
Recent Theoretical Insights into the Oxidative Degradation of Biopolymers and Plastics by Metalloenzymes 263
Computational study on the structural stability of mutated Affitins 263
Mechanistic and Physiological Implications of the Interplay among Iron-Sulfur Clusters in [FeFe]-Hydrogenases. A QM/MM Perspective 260
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 260
Activation of the N2 molecule by means of low-valence complexes of calcium and magnesium 257
A DFT and QM/MM Investigation on Models Related to the [FeFe]-Hydrogenase Active Site 256
CO Disrupts the Reduced H-Cluster of FeFe Hydrogenase. A Combined DFT and Protein Film Voltammetry Study 253
Computational investigation of proton reduction in [Fe-Fe]-hydrogenase bioinspired complexes: μ-H versus t-H 253
Mechanistic analysis of nucleophilic substrates oxidation by functional models of vanadium-dependent haloperoxidases: A density functional theory study 252
Regulation of hSos1 activity is a system-level property generated by its multi-domain structure 251
Author Correction: The oxidative inactivation of FeFe hydrogenase reveals the flexibility of the H-cluster (Nature Chemistry, (2014), 6, 4, (336-342), 10.1038/nchem.1892) 248
New fei-fei complex featuring a rotated conformation related to [2fe]h subsite of the [fe-fe] hydrogenase 247
DFT/TDDFT Exploration of the Potential Energy Surfaces of the Ground State and Excited States of Fe2(S2C3H6)(CO)6: A Simple Functional Model of the [FeFe] Hydrogenase Active Site 246
Reactivity of the Excited States of the H-Cluster of FeFe Hydrogenases 243
DFT investigation of the stereoelectronic properties of the [NiFe]-hydrogenases: catalytic cycle and oxidation mechanism 240
CO Affinity and Bonding Properties of [FeFe] Hydrogenase Active Site Models. A DFT Study 238
Proton Reduction and Dihydrogen Oxidation on Models of the [2Fe]H Cluster of [Fe]-Hydrogenases. A DFT Investigation. 237
Influence of key amino acid mutation on the active site structure and on folding in acetyl-CoA synthase: A theoretical perspective 236
DFT investigation of the Ni-A inactive state of the [NiFe]-hydrogenases: inactivation mechanism under aerobic conditions 233
Identification and in silico analysis of a new group of double-histone fold-containing proteins 232
Computational investigation on the spectroscopic properties of thiophene based europium β-diketonate complexes 232
A system-level analysis of regulation of hSos1, the major activator of the Ras oncoprotein 231
Protonation and electrochemical properties of a bisphosphide diiron hexacarbonyl complex bearing amino groups on the phosphide bridge 231
DFT investigation of binding and redox properties of the Hox state of [FeFe]-hydrogenases 227
Temperature Dependence of the Catalytic Two- versus Four-Electron Reduction of Dioxygen by a Hexanuclear Cobalt Complex 227
Relation between coordination geometry and stereoelectronic properties in DFT models of the CO-inhibited [FeFe]-hydrogenase cofactor 225
A DFT investigation on structural and redox properties of a synthetic Fe6S6 assembly closely related to the [FeFe]-hydrogenases active site 223
Isocyanide in Biochemistry? A Theoretical Investigation of the Electronic Effects and Energetics of Cyanide Ligand Protonation in [FeFe]-Hydrogenases 219
H2 binding and splitting on a new-generation [fefe]-hydrogenase model featuring a redox-active decamethylferrocenyl phosphine ligand: a theoretical investigation 218
In-silico Modeling of [FeFe]-hydrogenase chemistry 218
How general is the effect of the bulkiness of organic ligands on the basicity of metal-organic catalysts? H2-evolving Mo oxides/sulphides as case studies 217
BLUF Hydrogen network dynamics and UV/Vis spectra: a combined molecular dynamics and quantum chemical study 214
A DFT study of the influences of key amino acid mutation on local structural features and folding of Acetyl-CoA synthase 214
Electrocatalytic dihydrogen evolution mechanism of [Fe-2(CO)(4)(kappa(2)-Ph2PCH2CH2PPh2)(mu-S(CH2)(3)S)] and related models of the [FeFe]-hydrogenases active site: a DFT investigation 213
Targeting Intermediates of [FeFe]-Hydrogenase by CO and CN Vibrational Signatures 209
Magnetic Properties of [FeFe]-Hydrogenases: A Theoretical Investigation Based on Extended QM and QM/MM Models of the H-Cluster and Its Surroundings 209
New Systematic Route to Mixed-Valence Triiron Clusters Derived from Dinuclear Models of the Active Site of [Fe–Fe]-Hydrogenases 208
In silico functional characterization of a double histone fold domain from the Heliothis zea virus 1 207
Totale 32.561
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Categoria #
all - tutte 108.812
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 108.812
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2021/20221.905 215 250 245 170 104 147 102 84 102 66 145 275
2022/20232.627 336 705 302 245 197 394 35 121 144 29 80 39
2023/20241.757 57 62 88 126 251 375 340 88 127 32 35 176
2024/20255.053 247 518 242 293 434 273 359 255 505 769 435 723
2025/202615.780 2.016 1.081 952 1.352 1.394 642 1.965 524 1.028 2.924 928 974
2026/2027161 161 0 0 0 0 0 0 0 0 0 0 0
Totale 38.300