MACETTI, GIOVANNI
 Distribuzione geografica
Continente #
NA - Nord America 924
EU - Europa 624
AS - Asia 295
AF - Africa 45
SA - Sud America 42
OC - Oceania 5
Continente sconosciuto - Info sul continente non disponibili 1
Totale 1.936
Nazione #
US - Stati Uniti d'America 894
IT - Italia 223
CN - Cina 124
FR - Francia 76
DE - Germania 61
GB - Regno Unito 49
IN - India 36
NL - Olanda 29
JP - Giappone 27
RU - Federazione Russa 27
CZ - Repubblica Ceca 26
IE - Irlanda 25
ZA - Sudafrica 20
CA - Canada 19
CH - Svizzera 18
UA - Ucraina 18
ID - Indonesia 16
BR - Brasile 15
HK - Hong Kong 14
PL - Polonia 12
CO - Colombia 11
IR - Iran 11
MX - Messico 11
FI - Finlandia 10
VN - Vietnam 9
NG - Nigeria 8
PK - Pakistan 8
TH - Thailandia 8
CL - Cile 7
KR - Corea 7
MY - Malesia 7
PT - Portogallo 7
MM - Myanmar 6
SK - Slovacchia (Repubblica Slovacca) 6
AU - Australia 5
TW - Taiwan 5
VE - Venezuela 5
AE - Emirati Arabi Uniti 4
BE - Belgio 4
DZ - Algeria 4
GR - Grecia 4
PH - Filippine 4
RO - Romania 4
TR - Turchia 4
BG - Bulgaria 3
EG - Egitto 3
ES - Italia 3
RS - Serbia 3
IQ - Iraq 2
LT - Lituania 2
MA - Marocco 2
MD - Moldavia 2
MU - Mauritius 2
PE - Perù 2
SE - Svezia 2
SG - Singapore 2
SI - Slovenia 2
AR - Argentina 1
AT - Austria 1
BY - Bielorussia 1
DK - Danimarca 1
EE - Estonia 1
EU - Europa 1
GH - Ghana 1
HR - Croazia 1
LU - Lussemburgo 1
LV - Lettonia 1
NA - Namibia 1
NO - Norvegia 1
RE - Reunion 1
SA - Arabia Saudita 1
SO - Somalia 1
TN - Tunisia 1
UY - Uruguay 1
ZW - Zimbabwe 1
Totale 1.936
Città #
Milan 97
Fairfield 91
Houston 82
Ashburn 78
Ann Arbor 56
Seattle 47
Beijing 34
Buffalo 34
Santa Cruz 34
Woodbridge 25
Dublin 19
Hebei 19
Cambridge 18
Council Bluffs 18
Wuhan 16
Wilmington 15
Boardman 14
Los Angeles 12
Grenoble 9
Muizenberg 9
Paris 9
Chicago 8
Hong Kong 8
Jakarta 8
Shanghai 8
Nanning 7
Southend 7
Amsterdam 6
Clearwater 6
Helsinki 6
Mandalay 6
Monza 6
Ottawa 6
San Diego 6
Bengaluru 5
Bogotá 5
Brooklyn 5
Columbus 5
Düsseldorf 5
Frankfurt am Main 5
Fribourg 5
Jena 5
Munich 5
Pedrengo 5
Redmond 5
Salerno 5
Santiago 5
Taipei 5
Toronto 5
Warsaw 5
Zanjan 5
Bangkok 4
Bat Khela 4
Boydton 4
Bratislava 4
Cheseaux-sur-Lausanne 4
Fleming Island 4
Groningen 4
Guangzhou 4
Hamden 4
Hangzhou 4
Henderson 4
Kyoto 4
Las Vegas 4
London 4
Miami 4
Morrisville 4
Norwalk 4
Phoenix 4
Poznan 4
Segni 4
Tappahannock 4
University Park 4
Ahmedabad 3
Ashland 3
Belgrade 3
Cape Town 3
Caracas 3
Central 3
Durham 3
Edmonton 3
Florence 3
Grassobbio 3
Hanoi 3
Hope Valley 3
Hyderabad 3
Lausanne 3
Medellín 3
Milpitas 3
Minneapolis 3
Nancy 3
Patna 3
Pekanbaru 3
Porto 3
Pune 3
San Francisco 3
San Jose 3
Tianjin 3
Zhengzhou 3
Zurich 3
Totale 1.078
Nome #
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, file dfa8b994-2324-748b-e053-3a05fe0a3a96 347
Spin density accuracy and distribution in azido Cu(II) complexes : a source function analysis, file dfa8b99b-cc4f-748b-e053-3a05fe0a3a96 220
Insights on spin delocalization and spin polarization mechanisms in crystals of azido copper(II) dinuclear complexes through the electron spin density Source Function, file dfa8b999-183b-748b-e053-3a05fe0a3a96 189
Correlations of Crystal Structure and Solubility in Organic Salts: The Case of the Antiplasmodial Drug Piperaquine, file dfa8b99c-ecf0-748b-e053-3a05fe0a3a96 148
Unravelling the Chemistry of the [Cu(4,7-Dichloroquinoline)2Br2]2 Dimeric Complex through Structural Analysis: A Borderline Ligand Field Case, file dfa8b9a2-4faf-748b-e053-3a05fe0a3a96 142
A variable-temperature X-ray diffraction and theoretical study of conformational polymorphism in a complex organic molecule (DTC), file dfa8b99c-6323-748b-e053-3a05fe0a3a96 135
Spin Density Topology, file dfa8b9a3-3b71-748b-e053-3a05fe0a3a96 98
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, file dfa8b996-7bb0-748b-e053-3a05fe0a3a96 90
Experimental and theoretical study of the mechanism of action of the antimalarial drug chloroquine, file dfa8b995-f00b-748b-e053-3a05fe0a3a96 66
TOPOLOGICAL DESCRIPTORS ENABLING NOVEL DISSECTIONS OF ELECTRON POSITION AND SPIN PROPERTIES IN COMPLEX MOLECULAR SYSTEMS, file dfa8b99d-2415-748b-e053-3a05fe0a3a96 63
X-ray constrained spin-coupled technique: Theoretical details and further assessment of the method, file dfa8b9a1-5b12-748b-e053-3a05fe0a3a96 61
An Electron Density Source-Function Study of DNA Base Pairs in Their Neutral and Ionized Ground States, file 04fbb12a-b25d-494c-b8a9-107dc6e1b00e 52
Extracting Quantitative Information at Quantum Mechanical Level from Noncovalent Interaction Index Analyses, file 72c98e97-6cbc-4761-a31e-48c2331976bd 52
On the interplay among non-covalent interactions and activity of 4-aminoquinoline antimalarials: a crystallographic and spectroscopic study, file dfa8b999-1ca4-748b-e053-3a05fe0a3a96 44
Localized Molecular Orbital-Based Embedding Scheme for Correlated Methods, file 4e16886e-8f14-49c3-aed5-877cbdac45f6 29
Experimental X-ray Electron Density Study of Atomic Charges, Oxidation States, and Inverted Ligand Field in Cu(CF3)4-, file 83f6329f-77ed-4577-b017-83cca133bfb3 28
Initial maximum overlap method for large systems by the quantum mechanics/extremely localized molecular orbital embedding technique, file aa97be08-735a-42a6-9371-ed0b2cb4d93f 26
Correlations among solubility and crystal structure: a crystallographic and spectroscopic study of the antimalarial drug piperaquine, file dfa8b999-bdfc-748b-e053-3a05fe0a3a96 22
Getting more physical and chemical insight into electron spin density distributions and their accuracies, file dfa8b99b-d41f-748b-e053-3a05fe0a3a96 21
Full electron population analysis through the integration of the source function descriptor, file dfa8b99b-fb0d-748b-e053-3a05fe0a3a96 21
Milano Chemistry Molecular Simulation (MiCMoS): a versatile tool to study molecular systems in condensed phase, file 73cacde8-9206-4b32-a63c-77fe1a90531e 20
Initial Maximum Overlap Method Embedded with Extremely Localized Molecular Orbitals for Core-Ionized States of Large Systems, file bf952903-8925-434a-b447-4c5ab8f1f8ec 17
Classical Molecular Dynamics Simulation of Molecular Crystals and Materials: Old Lessons and New Perspectives, file 7e4f302f-2072-4d9e-a619-423cb96758f5 12
X-ray constrained spin-coupled technique: Theoretical details and further assessment of the method, file dfa8b9a2-e781-748b-e053-3a05fe0a3a96 11
Climbing Jacob's Ladder of Structural Refinement: Introduction of a Localized Molecular Orbital-Based Embedding for Accurate X-ray Determinations of Hydrogen Atom Positions, file 139024d5-6bb6-4f72-b180-e93b060b82c2 10
QM/ELMO: A Multi-Purpose Fully Quantum Mechanical Embedding Scheme Based on Extremely Localized Molecular Orbitals, file 5ac64b92-2acd-4d9f-b0ef-6c3c4a9cf02f 10
Quantum Mechanics/Extremely Localized Molecular Orbital Embedding Strategy for Excited States: Coupling to Time-Dependent Density Functional Theory and Equation-of-Motion Coupled Cluster, file 3316df15-6171-4d11-9814-d72eff4ae4f7 8
Three-Layer Multiscale Approach Based on Extremely Localized Molecular Orbitals to Investigate Enzyme Reactions, file 3d466506-af0e-4b9d-91a3-713203fd51cf 6
Study of molecular recognition of supercooled benzoic acid with MiCMoS, file 9f161be3-6c4b-4e0a-bd71-a738ceb8c425 5
X-ray constrained spin-coupled technique: Theoretical details and further assessment of the method, file dfa8b9a2-e780-748b-e053-3a05fe0a3a96 5
Symmetry-constrained Monte Carlo ​to predict the experimental crystal structures ​of small organic molecules​, file 49fd00d7-0c14-41c6-bd52-fcc0adf4a33d 4
Study of the key interactions in the self-recognition of the antimalarial drug chloroquine, file 5950afb6-3b88-4de3-8a20-3b17e4fd4b58 4
Chemical Bonding Investigations for Materials, file 68daf4d3-c0fb-498a-b004-49fa70debef3 4
Alkene carboamination/oxidative denitrogenation of 3-allyl-3-hydrazinylindolin-2-ones: one-pot entry to spirocyclopropyloxindoles, file bfb4c21d-4f33-4485-801c-53e4b284d56a 4
Extending libraries of extremely localized molecular orbitals to metal organic frameworks: A preliminary investigation, file c27f6e07-4635-410b-9a02-e7cf382f6d3c 4
Introduction of a weighting scheme for the X-ray restrained wavefunction approach: advantages and drawbacks, file 4fff1e9d-5c96-41d3-9a7b-ae3ae53081eb 3
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, file dfa8b994-4b12-748b-e053-3a05fe0a3a96 3
Spin density accuracy and distribution in azido Cu(II) complexes : a source function analysis, file dfa8b99a-5af2-748b-e053-3a05fe0a3a96 3
Quantum mechanics/extremely localized molecular orbital embedding technique: Theoretical foundations and further validation, file 04fda37a-9698-4e0f-afe2-718c1aa57947 2
Climbing Jacob's Ladder of Structural Refinement: Introduction of a Localized Molecular Orbital-Based Embedding for Accurate X-ray Determinations of Hydrogen Atom Positions, file 5bfaef4b-480d-47bb-b6e5-e8a1c8786b47 2
Quantum Mechanics/Extremely Localized Molecular Orbital Embedding Strategy for Excited States: Coupling to Time-Dependent Density Functional Theory and Equation-of-Motion Coupled Cluster, file 6865ede3-aed0-46cf-9a59-09d2d0b0becb 2
Molecular Dynamics Simulations of Small Organic Molecules in Confined Spaces, file 9385126d-5dad-4f85-b286-73a0640d34bc 2
QM/ELMO: A Multi-Purpose Fully Quantum Mechanical Embedding Scheme Based on Extremely Localized Molecular Orbitals, file 95a2d9ad-da2b-4420-84a1-555615ed6163 2
Post-Hartree-Fock methods for Hirshfeld atom refinement: are they necessary? Investigation of a strongly hydrogen-bonded molecular crystal, file bcc9df97-080c-4423-87f1-4bbe2b099bd3 2
Correlations of Crystal Structure and Solubility in Organic Salts: The Case of the Antiplasmodial Drug Piperaquine, file dfa8b99c-eced-748b-e053-3a05fe0a3a96 2
Molecular dynamics investigation of benzoic acid in confined spaces, file 0babed59-2899-4181-9d3a-e5d394cab586 1
Localized Molecular Orbital-Based Embedding Scheme for Correlated Methods, file 57cad8ec-038b-4f3a-ba9d-e9c15d61b4fa 1
X-ray restrained extremely localized molecular orbitals for the embedding of quantum mechanical calculations, file 865fa164-83ff-48ee-b6ad-b8561b0f0dba 1
Quantum Mechanics/Extremely Localized Molecular Orbital Method: A Fully Quantum Mechanical Embedding Approach for Macromolecules, file cc2afcff-81a8-4160-8b49-dd27ae7aa065 1
Symmetry-constrained Monte Carlo ​to predict the experimental crystal structures ​of small organic molecules​, file cd4adfb4-35fb-4252-b8ef-b0ad7d1042a7 1
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, file dfa8b993-f67f-748b-e053-3a05fe0a3a96 1
Electron transport in DNA bases: An extension of the Geant4-DNA Monte Carlo toolkit, file e44f89f0-94c8-40c8-a063-524f0f6ccf10 1
Totale 2.008
Categoria #
all - tutte 5.032
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 5.032


Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2018/201964 0 0 0 0 0 0 0 0 10 14 23 17
2019/2020276 17 10 14 41 24 15 15 27 36 33 17 27
2020/2021236 14 28 11 27 26 18 15 15 15 16 22 29
2021/2022425 41 29 27 72 58 14 25 22 21 16 61 39
2022/2023385 23 22 56 43 35 35 26 23 17 19 53 33
2023/2024486 45 42 52 41 69 59 43 80 55 0 0 0
Totale 2.008