CINECA IRIS Institutional Research Information System

CUPELLINI, LORENZO
 Distribuzione geografica
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Continente #
NA - Nord America 4.346
AS - Asia 2.427
EU - Europa 1.923
SA - Sud America 335
AF - Africa 82
OC - Oceania 4
Continente sconosciuto - Info sul continente non disponibili 1
Totale 9.118
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Nazione #
US - Stati Uniti d'America 4.262
SG - Singapore 870
IT - Italia 835
CN - Cina 751
HK - Hong Kong 345
BR - Brasile 279
SE - Svezia 273
VN - Vietnam 145
DE - Germania 130
BG - Bulgaria 119
KR - Corea 100
FR - Francia 93
GB - Regno Unito 85
NL - Olanda 72
FI - Finlandia 64
IN - India 64
BE - Belgio 63
RU - Federazione Russa 61
SN - Senegal 48
CA - Canada 47
AT - Austria 33
TR - Turchia 31
PL - Polonia 24
MX - Messico 23
AR - Argentina 22
JP - Giappone 21
IE - Irlanda 17
UA - Ucraina 15
ZA - Sudafrica 14
CO - Colombia 13
BD - Bangladesh 12
IQ - Iraq 12
ES - Italia 10
AE - Emirati Arabi Uniti 9
PK - Pakistan 9
UZ - Uzbekistan 8
EC - Ecuador 7
SA - Arabia Saudita 7
VE - Venezuela 7
IR - Iran 6
JO - Giordania 6
CI - Costa d'Avorio 5
CZ - Repubblica Ceca 5
KE - Kenya 5
LU - Lussemburgo 5
BH - Bahrain 4
CH - Svizzera 4
AZ - Azerbaigian 3
BO - Bolivia 3
DK - Danimarca 3
ID - Indonesia 3
IL - Israele 3
JM - Giamaica 3
KG - Kirghizistan 3
MY - Malesia 3
PY - Paraguay 3
TN - Tunisia 3
TT - Trinidad e Tobago 3
AU - Australia 2
BB - Barbados 2
BY - Bielorussia 2
CR - Costa Rica 2
DZ - Algeria 2
LB - Libano 2
MA - Marocco 2
NG - Nigeria 2
PA - Panama 2
RO - Romania 2
SY - Repubblica araba siriana 2
TW - Taiwan 2
AG - Antigua e Barbuda 1
AL - Albania 1
BA - Bosnia-Erzegovina 1
EU - Europa 1
GR - Grecia 1
HN - Honduras 1
IS - Islanda 1
KH - Cambogia 1
KI - Kiribati 1
KZ - Kazakistan 1
LI - Liechtenstein 1
MD - Moldavia 1
NO - Norvegia 1
NP - Nepal 1
NZ - Nuova Zelanda 1
OM - Oman 1
RE - Reunion 1
SK - Slovacchia (Repubblica Slovacca) 1
TH - Thailandia 1
TM - Turkmenistan 1
UY - Uruguay 1
Totale 9.118
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Città #
Ashburn 542
Singapore 495
Santa Clara 423
Dallas 397
Fairfield 374
Hong Kong 340
Woodbridge 292
Chandler 212
Seattle 208
Milan 192
Shanghai 187
Houston 160
Wilmington 143
Beijing 132
Hefei 132
Cambridge 129
Sofia 119
New York 116
Ann Arbor 101
Seoul 99
Princeton 98
Serra 96
Livorno 92
Boardman 91
Pisa 82
Los Angeles 80
Lawrence 54
Munich 50
Kraainem 49
Dakar 48
Medford 48
Marseille 39
Florence 37
Amsterdam 35
Vicopisano 33
Buffalo 32
Dong Ket 31
San Diego 30
São Paulo 30
Redondo Beach 28
Ottawa 27
Vienna 27
Lappeenranta 25
Frankfurt am Main 24
Ho Chi Minh City 24
Rome 24
Des Moines 23
Turku 22
London 21
Ogden 20
Council Bluffs 19
Pune 19
Istanbul 18
Nanjing 17
Warsaw 17
Dublin 16
Falls Church 16
Hanoi 16
Cascina 15
Nuremberg 15
Tokyo 15
Boulder 14
Chicago 13
Fuzhou 12
Mexico City 12
Amstelveen 10
Bogotá 10
Helsinki 10
Hyderabad 10
Norwalk 10
Rio de Janeiro 10
Ankara 9
Genoa 9
Quanzhou 9
Redwood City 9
Bologna 8
Brussels 8
Gaeta 8
Guangzhou 8
Hangzhou 8
Montreal 8
Orem 8
Shenyang 8
Atlanta 7
Colle Di Val D'elsa 7
Indianapolis 7
Mumbai 7
Tashkent 7
Turin 7
Zhengzhou 7
Amman 6
Belo Horizonte 6
Brasília 6
Dearborn 6
Paris 6
Poplar 6
San Francisco 6
Scuola 6
Toronto 6
Abidjan 5
Totale 6.615
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Nome #
The Multiple Roles of the Protein in the Photoactivation of Orange Carotenoid Protein 207
Efficient photoinduced charge separation in a BODIPY-C60 dyad 203
Single-chain self-folding in an amphiphilic copolymer: An integrated experimental and computational study 191
Successes & challenges in the atomistic modeling of light-harvesting and its photoregulation 191
The molecular mechanisms of light adaption in light-harvesting complexes of purple bacteria revealed by a multiscale modeling 187
Plasmon Enhanced Light Harvesting: Multiscale Modeling of the FMO Protein Coupled with Gold Nanoparticles 187
EXAT: EXcitonic analysis tool 172
Electronic Excitations in Nonpolar Solvents: Can the Polarizable Continuum Model Accurately Reproduce Solvent Effects? 171
An Ab Initio Description of the Excitonic Properties of LH2 and Their Temperature Dependence 170
Polarizable embedding QM/MM: the future gold standard for complex (bio)systems? 165
Quantum Chemical Modeling of the Photoinduced Activity of Multichromophoric Biosystems 149
A synthetic oxygen sensor for plants based on animal hypoxia signalling 149
Is energy transfer limiting multiphotochromism? Answers from ab initio quantifications 141
The energy transfer model of nonphotochemical quenching: Lessons from the minor CP29 antenna complex of plants 139
The nature of carotenoid S* state and its role in the nonphotochemical quenching of plants 136
Coupling to Charge Transfer States is the Key to Modulate the Optical Bands for Efficient Light Harvesting in Purple Bacteria 134
A Quantum Chemical Interpretation of Two-Dimensional Electronic Spectroscopy of Light-Harvesting Complexes 131
A ΔSCF model for excited states within a polarisable embedding 130
The atomistic modeling of light-harvesting complexes from the physical models to the computational protocol 130
A polarisable QM/MM description of NMR chemical shifts of a photoreceptor protein 128
Modeling the absorption lineshape of embedded systems from molecular dynamics: A tutorial review 127
Charge transfer from the carotenoid can quench chlorophyll excitation in antenna complexes of plants 126
Multiscale Models for Light-Driven Processes 125
How the pH Controls Photoprotection in the Light-Harvesting Complex of Mosses 124
Steric hindrances and spectral distributions affecting energy transfer rate: A comparative study on specifically designed donor-acceptor pairs 124
Modeling excitation energy transfer in multi-BODIPY architectures 123
Elucidating the role of structural fluctuations, and intermolecular and vibronic interactions in the spectroscopic response of a bacteriophytochrome 123
Structural and quantum chemical basis for OCP-mediated quenching of phycobilisomes 121
Coherence in carotenoid-to-chlorophyll energy transfer 119
Spectral variability in phycocyanin cryptophyte antenna complexes is controlled by changes in the α polypeptide chains 119
Electronic energy transfer in biomacromolecules 119
Atomic Detail of Protein Folding Revealed by an Ab Initio Reappraisal of Circular Dichroism 118
Protein control of photochemistry and transient intermediates in phytochromes 117
Photoprotection and triplet energy transfer in higher plants: The role of electronic and nuclear fluctuations 117
How orange carotenoid protein controls the excited state dynamics of canthaxanthin 116
The role of charge-transfer states in the spectral tuning of antenna complexes of purple bacteria 116
A polarizable QM/MM description of environment effects on NMR shieldings: from solvated molecules to pigment–protein complexes 110
A synthetic oxygen sensor for plants based on animal hypoxia signaling 110
Machine Learning Exciton Hamiltonians in Light-Harvesting Complexes 107
A Unique and Stable Polyproline I Helix Sorted out from Conformational Equilibrium by Solvent Polarity 107
Electron and excitation energy transfers in covalently linked donor-acceptor dyads: mechanisms and dynamics revealed using quantum chemistry 105
Electronic couplings for photo-induced processes from subsystem time-dependent density-functional theory: The role of the diabatization 103
Electrostatic embedding machine learning for ground and excited state molecular dynamics of solvated molecules 102
Modelling excitation energy transfer in covalently linked molecular dyads containing a BODIPY unit and a macrocycle 101
Combined spectroscopic and theoretical analysis of the binding of a water-soluble perylene diimide to DNA/RNA polynucleotides and G-quadruplexes 101
Fast Method for Excited-State Dynamics in Complex Systems and Its Application to the Photoactivation of a Blue Light Using Flavin Photoreceptor 100
The modeling of the absorption lineshape for embedded molecules through a polarizable QM/MM approach 99
From crystallographic data to the solution structure of photoreceptors: the case of the AppA BLUF domain 99
Importance of Polarizable Embedding for Computing Optical Rotation: The Case of Camphor in Ethanol 98
Absorption and Circular Dichroism Spectra of Molecular Aggregates With the Full Cumulant Expansion 97
Photoinduced electron transfer in 5-bromouracil labeled DNA. A contrathermodynamic mechanism revisited by electron transfer theories 96
The structural changes in the signaling mechanism of bacteriophytochromes in solution revealed by a multiscale computational investigation 96
A different perspective for nonphotochemical quenching in plant antenna complexes 96
First-principles simulation of excitation energy transfer and transient absorption spectroscopy in the CP29 light-harvesting complex 95
Exciton properties and optical spectra of light harvesting complex II from a fully atomistic description 94
Predicting Solvatochromism of Chromophores in Proteins through QM/MM and Machine Learning 93
A Computational Approach to Modeling Excitation Energy Transfer and Quenching in Light-Harvesting Complexes 93
Insights into Energy Transfer in Light-Harvesting Complex II Through Machine-Learning Assisted Simulations 92
QM/AMOEBA description of properties and dynamics of embedded molecules 92
The OpenMMPol library for polarizable QM/MM calculations of properties and dynamics 92
Density-Dependent Formulation of Dispersion-Repulsion Interactions in Hybrid Multiscale Quantum/Molecular Mechanics (QM/MM) Models 92
Probing the Effect of Mutations on Light Harvesting in CP29 by Transient Absorption and First-Principles Simulations 90
Ultrafast Transient Infrared Spectroscopy of Photoreceptors with Polarizable QM/MM Dynamics 90
Ultrafast excited-state dynamics of Luteins in the major light-harvesting complex LHCII 90
Understanding the influence of disorder on the exciton dynamics and energy transfer in Zn-phthalocyanine H-aggregates 86
Frenkel-exciton decomposition analysis of circular dichroism and circularly polarized luminescence for multichromophoric systems 85
Molecular Mechanisms of Activation in the Orange Carotenoid Protein Revealed by Molecular Dynamics 85
Computational Investigation of Structural and Spectroscopic Properties of LOV-Based Proteins with Improved Fluorescence 79
Electronic Excited States from Physically Constrained Machine Learning 73
Ultrafast Excited-State Dynamics of Carotenoids and the Role of the SX State 73
Tidying up the conformational ensemble of a disordered peptide by computational prediction of spectroscopic fingerprints 72
Exciton transport in molecular organic semiconductors boosted by transient quantum delocalization 71
Deciphering Photoreceptors Through Atomistic Modeling from Light Absorption to Conformational Response 70
Structure of the stress-related LHCSR1 complex determined by an integrated computational strategy 69
A fast method for electronic couplings in embedded multichromophoric systems 68
Protein-Driven Electron-Transfer Process in a Fatty Acid Photodecarboxylase 66
Excitonic Nature of Carotenoid-Phthalocyanine Dyads and Its Role in Transient Absorption Spectra 63
Uncovering the interactions driving carotenoid binding in light-harvesting complexes 58
Theoretical description of photoinduced electron transfer in donor-acceptor supramolecular complexes based on carbon buckybowls 50
Unravelling the ultrafast dynamics of a N-BODIPY compound 48
Transforming achiral semiconductors into chiral domains with exceptional circular dichroism 47
pH-Dependent Capping Interactions Induce Large-Scale Structural Transitions in i-Motifs 47
Integrated Computational Study of the Light-Activated Structure of the AppA BLUF Domain and Its Spectral Signatures 44
Origin of Low-Lying Red States in the Lhca4 Light-Harvesting Complex of Photosystem I 43
Energetic Landscape and Terminal Emitters of Phycobilisome Cores from Quantum Chemical Modeling 41
null 35
Quantum chemical elucidation of a sevenfold symmetric bacterial antenna complex 31
Enabling Stereochemical Communication and Stimuli-Responsive Chiroptical Properties in Biphenyl-Capped Cyclodextrins 29
Structural determinants for red-shifted absorption in higher-plants Photosystem I 26
Multiscale Simulation of Photoinduced Electron Transfer in Cryptochrome 4 from European Robin and Pigeon Indicates a Conserved Dynamics 23
Origins of curvature in meso-tetra(4-sulfonatophenyl) porphine aggregation: molecular dynamics and electronic spectroscopy 16
On the breakdown of Förster energy transfer theory due to solvent effects: atomistic simulations unveil distance-dependent dielectric screening in calmodulin 6
Exciton Delocalization Promotes Far-Red Absorption in a Tetrameric Chlorophyll a Light-Harvesting Complex from Trachydiscus minutus 2
Quantum Dynamics Simulations Reveal Ultrafast and Coherent Charge Transfer in the Lhca4 Antenna of Photosystem I 1
Totale 9.392
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Categoria #
all - tutte 30.717
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 30.717
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021527 0 0 0 0 0 31 13 29 148 111 110 85
2021/2022680 8 23 11 41 130 87 28 21 44 14 51 222
2022/2023750 96 87 75 28 67 97 6 69 166 3 36 20
2023/2024968 57 71 75 77 152 173 27 88 20 54 79 95
2024/20252.688 11 90 22 103 298 330 302 101 288 318 393 432
2025/20262.165 298 511 428 275 405 248 0 0 0 0 0 0
Totale 9.392