IRIS Institutional Research Information System - AIR Archivio Istituzionale della Ricerca

MACETTI, GIOVANNI
 Distribuzione geografica
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Continente #
AS - Asia 3.055
NA - Nord America 2.559
EU - Europa 1.895
SA - Sud America 335
AF - Africa 67
OC - Oceania 11
Continente sconosciuto - Info sul continente non disponibili 3
Totale 7.925
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Nazione #
US - Stati Uniti d'America 2.477
CN - Cina 1.025
SG - Singapore 941
IT - Italia 589
GB - Regno Unito 317
HK - Hong Kong 314
BR - Brasile 263
RU - Federazione Russa 211
VN - Vietnam 210
DE - Germania 171
IN - India 148
FR - Francia 129
SE - Svezia 121
BD - Bangladesh 104
ID - Indonesia 83
NL - Olanda 65
KR - Corea 51
FI - Finlandia 43
IE - Irlanda 43
CA - Canada 39
JP - Giappone 38
PL - Polonia 30
UA - Ucraina 30
MX - Messico 27
CH - Svizzera 25
DK - Danimarca 24
TR - Turchia 22
AR - Argentina 21
ES - Italia 20
PK - Pakistan 16
ZA - Sudafrica 16
AT - Austria 14
EC - Ecuador 14
CI - Costa d'Avorio 13
GR - Grecia 13
IQ - Iraq 13
TW - Taiwan 13
MY - Malesia 12
PH - Filippine 12
AU - Australia 11
CZ - Repubblica Ceca 11
CL - Cile 10
UZ - Uzbekistan 9
DZ - Algeria 8
NP - Nepal 8
RO - Romania 8
VE - Venezuela 8
CO - Colombia 7
MA - Marocco 7
TH - Thailandia 7
AL - Albania 6
PE - Perù 6
AE - Emirati Arabi Uniti 5
LT - Lituania 5
BE - Belgio 4
KE - Kenya 4
PT - Portogallo 4
SA - Arabia Saudita 4
AO - Angola 3
CR - Costa Rica 3
HN - Honduras 3
PR - Porto Rico 3
SC - Seychelles 3
SK - Slovacchia (Repubblica Slovacca) 3
TN - Tunisia 3
UY - Uruguay 3
ZW - Zimbabwe 3
AM - Armenia 2
BH - Bahrain 2
EG - Egitto 2
GT - Guatemala 2
IL - Israele 2
IR - Iran 2
KG - Kirghizistan 2
LU - Lussemburgo 2
OM - Oman 2
PY - Paraguay 2
AZ - Azerbaigian 1
BB - Barbados 1
BG - Bulgaria 1
BN - Brunei Darussalam 1
BO - Bolivia 1
BW - Botswana 1
CW - ???statistics.table.value.countryCode.CW??? 1
CY - Cipro 1
DO - Repubblica Dominicana 1
ET - Etiopia 1
EU - Europa 1
HU - Ungheria 1
JM - Giamaica 1
JO - Giordania 1
KH - Cambogia 1
KZ - Kazakistan 1
LV - Lettonia 1
MT - Malta 1
MU - Mauritius 1
NG - Nigeria 1
NI - Nicaragua 1
NO - Norvegia 1
PA - Panama 1
Totale 7.919
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Città #
Singapore 481
Dallas 384
Ashburn 275
Hong Kong 257
Milan 256
San Jose 255
Hefei 201
Southend 182
Council Bluffs 118
Beijing 107
Chandler 98
Fairfield 86
Bengaluru 79
Los Angeles 79
Wilmington 68
New York 63
Ho Chi Minh City 61
Hanoi 59
Lauterbourg 59
Santa Clara 58
Jakarta 57
Seattle 50
Guangzhou 49
Houston 43
Frankfurt am Main 40
Dublin 39
Ann Arbor 37
Princeton 36
Seoul 36
Buffalo 34
Cambridge 32
São Paulo 32
Moscow 31
Woodbridge 28
Munich 27
Phoenix 27
Rome 26
Shanghai 22
Tokyo 22
Boardman 20
Chicago 20
Columbus 20
Nanjing 20
Tianjin 19
Changsha 17
Dearborn 17
Helsinki 17
Jinan 17
Bergamo 16
Cangzhou 16
Lappeenranta 15
Nuremberg 15
Mong Kok 14
Warsaw 14
Abidjan 13
Shenyang 13
Atlanta 12
Des Moines 12
Norwich 12
Roxbury 12
Bochum 11
Cremona 11
Fuzhou 11
Hebei 11
Montreal 11
Quanzhou 11
Redwood City 11
Shenzhen 11
Zanè 11
Falls Church 10
London 10
North Bergen 10
Pittsburgh 10
Prague 10
Rio de Janeiro 10
Basingstoke 9
Chennai 9
Durham 9
Haiphong 9
Hangzhou 9
Medford 9
Rho 9
San Diego 9
Tashkent 9
Thessaloniki 9
Zhengzhou 9
Berlin 8
Ferrara 8
Istanbul 8
Mexico City 8
Rochester 8
Washington 8
Brooklyn 7
Da Nang 7
Fribourg 7
Manchester 7
Quito 7
Vienna 7
Benito Juarez 6
Bexley 6
Totale 4.585
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Nome #
Classical Molecular Dynamics Simulation of Molecular Crystals and Materials: Old Lessons and New Perspectives 302
Rotational Motion in Bispidines: A Conformational Study 254
A variable-temperature X-ray diffraction and theoretical study of conformational polymorphism in a complex organic molecule (DTC) 251
Experimental and theoretical study of the mechanism of action of the antimalarial drug chloroquine 246
On the molecular basis of the activity of the antimalarial drug chloroquine : EXAFS-assisted DFT evidence of a direct Fe–N bond with free heme in solution 240
Correlations of Crystal Structure and Solubility in Organic Salts: The Case of the Antiplasmodial Drug Piperaquine 227
TOPOLOGICAL DESCRIPTORS ENABLING NOVEL DISSECTIONS OF ELECTRON POSITION AND SPIN PROPERTIES IN COMPLEX MOLECULAR SYSTEMS 221
Correlations among solubility and crystal structure: a crystallographic and spectroscopic study of the antimalarial drug piperaquine 212
Full electron population analysis through the integration of the source function descriptor 195
On the interplay among non-covalent interactions and activity of 4-aminoquinoline antimalarials: a crystallographic and spectroscopic study 191
Intermolecular Recognition of the Antimalarial Drug Chloroquine : A Quantum Theory of Atoms in Molecules–Density Functional Theory Investigation of the Hydrated Dihydrogen Phosphate Salt from the 103 K X-ray Structure 190
Milano Chemistry Molecular Simulation (MiCMoS): a versatile tool to study molecular systems in condensed phase 179
Study of the key interactions in the self-recognition of the antimalarial drug chloroquine 178
Understanding self-recognition in the antimalarial drug chloroquine: an experimental and theoretical charge density study 177
Molecular Dynamics Simulations of Small Organic Molecules in Confined Spaces 177
Spin density accuracy and distribution in azido Cu(II) complexes : a source function analysis 167
Unravelling the Chemistry of the [Cu(4,7-Dichloroquinoline)2Br2]2 Dimeric Complex through Structural Analysis: A Borderline Ligand Field Case 165
First-principles study of dynamic symmetry in acrylic acid 158
Study of molecular recognition of supercooled benzoic acid with MiCMoS 142
Revisiting the Reduction of Vinpocetine 140
Insights on spin delocalization and spin polarization mechanisms in crystals of azido copper(II) dinuclear complexes through the electron spin density Source Function 138
Experimental X-ray Electron Density Study of Atomic Charges, Oxidation States, and Inverted Ligand Field in Cu(CF3)4- 137
Innovative On-Resin and in Solution Peptidomimetics Synthesis via Metal-Free Photocatalytic Approach 137
Spin Density Topology 135
Subcritical clusters of liquid benzoic acid: insights from molecular dynamics simulations 127
Getting more physical and chemical insight into electron spin density distributions and their accuracies 121
On the solubility of azodicarbonamide in water/DMSO mixtures: an experimental and computational study 120
Extracting Quantitative Information at Quantum Mechanical Level from Noncovalent Interaction Index Analyses 118
Pre-nucleation clusters in liquid benzoic acid 118
Unveiling interactions of the antimalarial drug chloroquine with haeme in aqueous solutions through spectroscopic and quantum mechanical methods 118
Symmetry-constrained Monte Carlo to predict the experimental crystal structure of small organic molecules 117
Symmetry-constrained Monte Carlo ​to predict the experimental crystal structures ​of small organic molecules​ 115
Molecular dynamics investigation of benzoic acid in confined spaces 112
X-ray constrained spin-coupled technique: Theoretical details and further assessment of the method 111
Lattice dynamics and polar domain structure of giant-refraction K0.997Li0.003Ta0.64Nb0.36O3 solid solution 109
Nanoscale inhomogeneities in undercooled benzoic acid: A molecular dynamics study 107
Study of pre-nucleation clusters of liquid benzoic acid by molecular dynamics simulations 103
Alkene carboamination/oxidative denitrogenation of 3-allyl-3-hydrazinylindolin-2-ones: one-pot entry to spirocyclopropyloxindoles 103
Doubly Metathetic NiCl2-Catalyzed Coupling Between Bis(2-oxazolines) and Aldehydes: A Novel Access to Bis(ester-imine) Derivatives 102
Structure-properties relationships in complex Li-doped KTa/NbO3 perovskite ferroelectrics 101
QM/ELMO: A Multi-Purpose Fully Quantum Mechanical Embedding Scheme Based on Extremely Localized Molecular Orbitals 96
Chemical Bonding Investigations for Materials 93
Introduction of a weighting scheme for the X-ray restrained wavefunction approach: advantages and drawbacks 91
How small a molecular crystal can be? Looking for Hidden Crystalline Aggregates in Dissolving Benzoic Acid Nanoparticles 91
An Electron Density Source-Function Study of DNA Base Pairs in Their Neutral and Ionized Ground States 89
Initial maximum overlap method for large systems by the quantum mechanics/extremely localized molecular orbital embedding technique 87
Nanoscale distortions produce mesoscale modulations in Li-doped KTa/NbO3 perovskite ferroelectrics: a crystallographic study 83
Quantification of the Magnetic Anisotropy of a Single-Molecule Magnet from the Experimental Electron Density 79
Quantum Mechanics/Extremely Localized Molecular Orbital Embedding Strategy for Excited States: Coupling to Time-Dependent Density Functional Theory and Equation-of-Motion Coupled Cluster 78
Quantum Mechanics/Extremely Localized Molecular Orbital Method: A Fully Quantum Mechanical Embedding Approach for Macromolecules 76
Climbing Jacob's Ladder of Structural Refinement: Introduction of a Localized Molecular Orbital-Based Embedding for Accurate X-ray Determinations of Hydrogen Atom Positions 76
Monte Carlo simulations of electron interactions with the DNA molecule: A complete set of physics models for Geant4-DNA simulation toolkit 74
On the role of isomeric composition in determining the stability of liquid phases: A Molecular Dynamics study of acetaldehyde phenylhydrazone 71
Initial Maximum Overlap Method Embedded with Extremely Localized Molecular Orbitals for Core-Ionized States of Large Systems 71
Lattice dynamics and polar domain structure of giant-refraction K0.997 Li0.003 Ta0.64 Nb0.36 O3 solid solution 65
Three-Layer Multiscale Approach Based on Extremely Localized Molecular Orbitals to Investigate Enzyme Reactions 65
Stereodefined synthesis of 3-difluoromethyl-benzoxaboroles: novel antimicrobials with unlocked H-bonding 63
Localized Molecular Orbital-Based Embedding Scheme for Correlated Methods 61
Post-Hartree-Fock methods for Hirshfeld atom refinement: are they necessary? Investigation of a strongly hydrogen-bonded molecular crystal 59
Expanding the Chemical Space of Sugar Frameworks by Quaternization of the Anomeric Carbon Atom 57
Electron transport in DNA bases: An extension of the Geant4-DNA Monte Carlo toolkit 57
Sustainable electrochemical synthesis of a new isoxazoline scaffold as turn inducer to build parallel β-hairpins 55
Quantum mechanics/extremely localized molecular orbital embedding technique: Theoretical foundations and further validation 51
X-ray restrained extremely localized molecular orbitals for the embedding of quantum mechanical calculations 47
Extending libraries of extremely localized molecular orbitals to metal organic frameworks: A preliminary investigation 46
Symmetry-Constrained Monte Carlo for the Crystal Structure Prediction of Small Organic Molecules 43
Chasing Crystal Embryos of Benzoic Acid with Classical Molecular Dynamics 41
Experimental and computational study of the crystal packing of isoelectronic 4,11-diaza[5]helicene and 4,7,8,11-tetraaza[5]helicene 34
Electrochemical Intramolecular Aminobromination of Alkenes 18
Photochemical C4-Selective C-H Amination of Quinolines via N-Shift of Heteroaryl Azides 8
Totale 8.286
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Categoria #
all - tutte 23.531
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 23.531
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/202120 0 0 0 0 0 0 0 0 0 0 7 13
2021/2022286 24 24 21 24 23 16 18 14 21 22 10 69
2022/2023412 34 45 34 35 32 70 2 17 53 0 57 33
2023/2024524 36 43 39 31 103 25 20 38 24 55 52 58
2024/20251.709 79 192 33 188 84 100 80 157 84 139 172 401
2025/20264.321 363 581 606 412 327 259 444 212 460 303 354 0
Totale 8.286