UniSa - IRIS Institutional Research Information System

CIMINO, Paola
 Distribuzione geografica
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Continente #
NA - Nord America 2.754
EU - Europa 830
AS - Asia 554
SA - Sud America 29
AF - Africa 6
Continente sconosciuto - Info sul continente non disponibili 6
OC - Oceania 2
Totale 4.181
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Nazione #
US - Stati Uniti d'America 2.736
UA - Ucraina 257
CN - Cina 232
SG - Singapore 173
IT - Italia 150
RU - Federazione Russa 142
IE - Irlanda 78
DE - Germania 70
VN - Vietnam 64
FI - Finlandia 55
TR - Turchia 43
SE - Svezia 42
BR - Brasile 26
KR - Corea 19
CA - Canada 13
IN - India 10
DK - Danimarca 6
EU - Europa 6
GB - Regno Unito 6
ES - Italia 5
IL - Israele 5
NL - Olanda 5
GT - Guatemala 4
AT - Austria 3
BD - Bangladesh 2
BE - Belgio 2
HK - Hong Kong 2
JP - Giappone 2
SC - Seychelles 2
UZ - Uzbekistan 2
ZA - Sudafrica 2
AU - Australia 1
BG - Bulgaria 1
BO - Bolivia 1
EE - Estonia 1
FR - Francia 1
HU - Ungheria 1
IM - Isola di Man 1
LI - Liechtenstein 1
MA - Marocco 1
MX - Messico 1
NG - Nigeria 1
NZ - Nuova Zelanda 1
PT - Portogallo 1
PY - Paraguay 1
RO - Romania 1
SK - Slovacchia (Repubblica Slovacca) 1
UY - Uruguay 1
Totale 4.181
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Città #
Ann Arbor 788
Chandler 384
Jacksonville 313
Woodbridge 218
Princeton 211
Houston 156
Wilmington 124
Dublin 77
Singapore 72
Dong Ket 64
Nanjing 64
Boardman 57
Andover 55
Pellezzano 48
Izmir 42
Beijing 37
Ashburn 35
Moscow 24
Changsha 16
Fairfield 15
Nanchang 15
Shenyang 15
Hebei 14
Salerno 14
Düsseldorf 13
Guangzhou 12
Jiaxing 12
Ottawa 12
Norwalk 11
Pune 9
Redwood City 9
Dearborn 8
Mestre 7
Milan 7
Napoli 7
Rome 7
Des Moines 6
Naples 6
Tianjin 6
Council Bluffs 5
Roccarainola 5
San Diego 5
Aarhus 4
Amsterdam 4
Frankfurt am Main 4
Guatemala City 4
Madrid 4
Hefei 3
Helsinki 3
Indiana 3
Los Angeles 3
Rio de Janeiro 3
The Dalles 3
Zhengzhou 3
Assago 2
Baotou 2
Brussels 2
Cambridge 2
Catania 2
Chicago 2
Copenhagen 2
Dallas 2
Edinburgh 2
Hong Kong 2
Jinan 2
Johannesburg 2
London 2
New York 2
Nocera Superiore 2
Petritoli 2
Rumford 2
Santa Clara 2
Seattle 2
Shanghai 2
Shenzhen 2
Spinea 2
Stockholm 2
São Paulo 2
Taizhou 2
Tappahannock 2
Tashkent 2
Tel Aviv 2
Aci Catena 1
Acireale 1
Asunción 1
Athenry 1
Bauru 1
Belo Horizonte 1
Bologna 1
Budapest 1
Calvizzano 1
Campina Grande 1
Cariacica 1
Centrale 1
Cincinnati 1
Clifton 1
Cochabamba 1
Conceição do Coité 1
Contagem 1
Damascus 1
Totale 3.120
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Nome #
Accurate and feasible computations of structural and magnetic properties of large free radicals: The PBE0/N07D model 129
Stereochemical analysis of natural products. Approaches relying on the combination of NMR spectroscopy and computational methods 111
Aplysiols A and B, squalene-derived polyethers from the mantle of the sea hare Aplysia dactylomela 107
Theoretical and computational tools to understand the spectroscopy and reactivity of bio-molecules 106
Interplay of stereo-electronic, environmental, and dynamical effects in determining the EPR parameters of aromatic spin-probes: INDCO as a test case 96
Ab initio computation of spectroscopic parameters as a tool for the structural elucidation of organic systems. 96
Accurate Infrared (IR) Spectra for Molecules Containing the C≡N Moiety by Anharmonic Computations with the Double Hybrid B2PLYP Density Functional 95
Interplay of stereoelectronic, vibrational and environmental effects in tuning physico chemical properties of carbon-centered radicals. 92
Use of Integrated Computational Approaches in the Search for New Therapeutic Agents 91
Relative configuration analysis of flexible systems by nmr spectroscopy 88
Development and validation of the B3LYP/N07D computational model for structural parameter and magnetic tensors of large free radicals 88
CC/DFT Route toward Accurate Structures and Spectroscopic Features for Observed and Elusive Conformers of Flexible Molecules: Pyruvic Acid as a Case Study 88
Cross-linked adducts between guanine and thymine mediated by hydroxyl radical and one-electron oxidation: a theoretical study 87
Effects of molecular dynamics and solvation on the electronic structure of molecular probes 87
Exploring the reactivity by integrating the intrinsic reaction coordinate: The excited state proton transfer in the Green Fluorescent Protein 85
On the interpretation of continuous wave electron spin resonance spectra of tempo-palmitate in 5-cyanobiphenyl 84
Nucleophilic Cyclopropane Ring Opening in Duocarmycin SA Derivatives by Methanol under Acid Conditions: A Quantum Mechanical Study in the Gas-Phase and in Solution 83
Excited State Time-Resolved Vibrational Dynamics: the Challenge of Charge Transfer Complexes 82
Extension of the J-Based Configuration Analysis to Multiple Conformer Equilibria: An Application to Sapinofuranone A. 80
Xanthones from calli of Hypericum perforatum subsp. perforatum 78
Comparison of different theory models and basis sets in the calculation of 13C NMR chemical shifts of natural products 77
An integrated computational protocol for the accurate prediction of EPR and PNMR parameters of aminoxyl radicals in solution 77
Ab Initio Modeling of CW-ESR Spectra of the Double Spin Labeled Peptide Fmoc-(Aib-Aib-TOAC)2-Aib-OMe in Acetonitrile 76
Structural determination of the O-deacetylated O-chain of lipopolysaccharide from Burkholderia (Pseudomonas) cepacia strain PVFi-5A. 75
Synthesis, conformational analysis and CB1 binding affinity of hairpin-like anandamide pseudopeptide mimetics 75
Cost-effective solar concentrators based on red fluorescent Zn(ii)–salicylaldiminato complex 75
NMR structure of the (+)-CPI-indole/d(GACTAATTGAC)-d(GTCAATTAGTC) covalent complex. 74
Regioselectivity and Nucleophilic Control in the Cyclopropane Ring Opening of Duocarmycin SA Derivatives under Neutral and Acid Conditions: A Quantum Mechanical Study in the Gas Phase and in Solution. 74
Validation of the B3LYP/N07D and PBE0/N07D computational models for the calculation of electronic g-tensors 74
Halogen bonds between TEMPO radical and CxHyFzI species: DFT calculations of physico-chemical properties and comparison with hydrogen bonded adducts 72
Vitamin C: An Experimental and Theoretical Study on the Gas Phase Structure and Ion Energetics of Protonated Ascorbic Acid 72
Recent acquisitions in the resolution of structural problems by NMR and quantum mechanical methods 70
Calculation of Magnetic Tensors and EPR Spectra for Free Radicals in Different Environments 69
Isolation and NMR characterization of rosacelose, a novel sulfated polysaccharide from the sponge Mixylla rosacea. 68
On the Driving Force of the Excited-State Proton Shuttle in the Green Fluorescent Protein: A Time-Dependent Density Functional Theory (TD-DFT) Study of the Intrinsic Reaction Path 68
Matrix EPR and QM study of a model aromatic thioether radical-cation 66
Solvent effects on molecular interactions: new hints from an integrated density functional/polarizable continuum model. 65
Chemical composition of exopolysaccharide fractions from phytopathogenic strains of Pseudomonas syringae subsp. savastanoi. 65
Magnetic Interactions in Phenyl-Bridged Nitroxide Diradicals: Conformational Effects by Multi-reference and Broken Symmetry DFT Approaches. 65
EPR spectra of organic free radicals in solution from an integrated computational approach 62
Interplay of intrinsic, environmental, and dynamic effects in tuning the EPR parameters of nitroxides: further insights from an integrated computational approach 61
Simulation of 2D 1H homo- and 1H-13C heteronuclear NMR spectra of organic molecules by DFT calculations of spin-spin coupling constants and 1H and 13C-chemical shifts. 60
Development and Validation of an Integrated Computational Approach for the Modeling of cw-ESR Spectra of Free Radicals in Solution: p-(Methylthio)phenyl Nitronylnitroxide in Toluene as a Case Study. 57
On the role of stereo-electronic effects in tuning the selectivity and rate of DNA alkylation by duocarmycins. 56
On the different strength of photoacids 56
Structural revision of halipeptins: synthesis of thiazoline unit and isolation of halipeptin C 55
Evidence of Variable H-Bond Network for Nitroxide Radicals in Protic Solvents 54
Gas Phase Ion Chemistry of Diphosphate Anions as a Tool to Investigate the Intrinsic Requirements of Phosphate Esters Enzymatic Reactions. The [MIMIIHP2O7]- ions. 52
Magneto-Structural Relationships for Radical Cation and Neutral Pyridinophane Structures with Intrabridgehead Nitrogen Atoms. An Integrated Experimental and Quantum Mechanical Study. 52
Extension of the AMBER force-field for the study of large nitroxides in condensed phases: an ab initio parameterization 52
Double C-H Activation of Ethane by Metal-Free SO(2)(center dot+) Radical Cations 51
Exploring the Franck–Condon region of a photoexcited charge transfer complex in solution to in-terpret femtosecond stimulated Raman spectroscopy: excited state electronic structure methods to unveil non-radiative pathways 51
Interplay of Stereoelectronic and Environmental Effects in Tuning the Structural and Magnetic Properties of a Prototypical Spin Probe: Further Insights from a First Principle Dynamical Approach. 50
Structural, thermodynamic, and magnetic properties of adducts between TEMPO radical and alcohols in solution: New insights from DFT and discrete-continuum solvent models. 48
Radiation-induced formation of DNA intrastrand crosslinks between thymine and adenine bases: a theoretical approach 48
Insight into the mechanism of action of plakortins, simple 1,2-dioxane antimalarials 46
Unraveling Solvent-Driven Equilibria between α- and 310-Helices through an Integrated Spin Labeling and Computational Approach 43
Insight into the mechanism of action of marine cytotoxic thiazinoquinones 37
Electronic and Vibrational Manifold of Tetracyanoethylene-Chloronaphthalene Charge Transfer Complex in Solution: Insights from TD-DFT and Ab Initio Molecular Dynamics 29
Ultrafast photo-induced processes in complex environments: The role of accuracy in excited-state energy potentials and initial conditions 22
From ascorbic acid to furan derivatives: The gas phase acid catalyzed degradation of vitamin C 22
Totale 4.274
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Categoria #
all - tutte 14.646
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 14.646
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/202089 0 0 0 0 0 0 0 0 0 0 76 13
2020/2021430 4 49 51 2 59 17 55 2 55 1 60 75
2021/2022398 13 5 1 1 13 10 2 10 60 53 59 171
2022/2023832 69 74 13 146 103 166 0 77 124 1 44 15
2023/2024181 25 38 12 6 8 21 7 8 1 10 15 30
2024/2025380 32 6 15 17 10 84 89 70 44 11 2 0
Totale 4.274