IRIS
ASCHI, MASSIMILIANO
 Distribuzione geografica
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Continente #
NA - Nord America 5.729
EU - Europa 3.755
AS - Asia 2.765
SA - Sud America 270
Continente sconosciuto - Info sul continente non disponibili 8
OC - Oceania 8
AF - Africa 7
Totale 12.542
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Nazione #
US - Stati Uniti d'America 5.710
IE - Irlanda 1.134
SG - Singapore 852
CN - Cina 799
TR - Turchia 554
HK - Hong Kong 464
RU - Federazione Russa 446
DE - Germania 414
SE - Svezia 408
IT - Italia 356
UA - Ucraina 318
GB - Regno Unito 282
BR - Brasile 242
FI - Finlandia 168
FR - Francia 126
NL - Olanda 37
IN - India 27
BE - Belgio 26
CA - Canada 15
CZ - Repubblica Ceca 15
AR - Argentina 9
KR - Corea 9
EU - Europa 8
VN - Vietnam 7
IQ - Iraq 6
AU - Australia 5
EC - Ecuador 5
ES - Italia 5
JP - Giappone 5
KZ - Kazakistan 5
VE - Venezuela 5
BD - Bangladesh 4
CO - Colombia 4
PK - Pakistan 4
UZ - Uzbekistan 4
AE - Emirati Arabi Uniti 3
AT - Austria 3
AZ - Azerbaigian 3
IL - Israele 3
IR - Iran 3
NZ - Nuova Zelanda 3
PY - Paraguay 3
BG - Bulgaria 2
BN - Brunei Darussalam 2
CH - Svizzera 2
EG - Egitto 2
HU - Ungheria 2
KG - Kirghizistan 2
LT - Lituania 2
RO - Romania 2
SY - Repubblica araba siriana 2
AO - Angola 1
BA - Bosnia-Erzegovina 1
BH - Bahrain 1
DK - Danimarca 1
DZ - Algeria 1
HN - Honduras 1
HR - Croazia 1
JO - Giordania 1
LK - Sri Lanka 1
MA - Marocco 1
MD - Moldavia 1
MK - Macedonia 1
MX - Messico 1
MY - Malesia 1
NG - Nigeria 1
NP - Nepal 1
OM - Oman 1
PA - Panama 1
PE - Perù 1
PL - Polonia 1
QA - Qatar 1
RS - Serbia 1
SV - El Salvador 1
UY - Uruguay 1
ZA - Sudafrica 1
Totale 12.542
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Città #
Jacksonville 1.245
Chandler 1.229
Dublin 1.132
Hong Kong 461
Boardman 443
Santa Clara 392
Singapore 391
Izmir 258
Nanjing 234
San Mateo 232
Wilmington 179
Lawrence 168
Princeton 168
New York 130
Moscow 118
Ann Arbor 99
Ashburn 99
Nanchang 85
Des Moines 73
Milan 66
L'aquila 63
Seattle 59
Shenyang 48
Woodbridge 48
Verona 44
Hebei 43
Tianjin 42
Beijing 41
Rome 31
Jiaxing 30
Changsha 27
Helsinki 27
Brussels 25
Council Bluffs 25
Los Angeles 25
Shanghai 24
Kunming 21
Dallas 19
Hangzhou 19
Bremen 18
Pune 18
Jinan 17
Mountain View 17
The Dalles 17
Paris 16
São Paulo 16
Zhengzhou 16
Lanzhou 15
Norwalk 14
Changchun 13
Ningbo 13
Rio de Janeiro 13
Brno 12
Falls Church 12
Munich 12
Philadelphia 12
Taizhou 12
Guangzhou 11
Monterosi 11
Kitzingen 9
L’Aquila 9
London 8
Nuremberg 8
Auburn Hills 7
Frankfurt am Main 7
Dearborn 6
Düsseldorf 6
Toronto 6
Dong Ket 5
Falkenstein 5
Guarulhos 5
Santo André 5
Shenzhen 5
Terni 5
Amsterdam 4
Baghdad 4
Berlin 4
Brasília 4
Campo Grande 4
Curitiba 4
Franca 4
Fremont 4
Grafing 4
Ottawa 4
Portici 4
Tappahannock 4
Tashkent 4
Tokyo 4
Asunción 3
Auckland 3
Baku 3
Bogotá 3
Cabo Frio 3
Cedar Knolls 3
Chicago 3
Dhaka 3
Dubai 3
Edinburgh 3
Goiânia 3
Hefei 3
Totale 8.336
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Nome #
Inclusion of cybotactic effect in the theoretical modeling of absorption spectra of liquid-state systems with perturbed matrix method and molecular dynamics simulations: the UV-Vis absorption spectrum of para-nitroaniline as a case study 144
Crabrolin, a natural antibiotic peptide: structural properties 115
Bovine lactoferrin and its tryptic peptides: Antibacterial activity against different species 104
Dioxomolybdenum(VI) compounds with alpha-amino acid donor ligands as catalytic precursors for the selective oxyfunctionalization of olefins 104
A density functional theory study of hexafluoropropene: the low-lying singlet excited states and primary photodissociation channel 100
Theoretical-computational modeling of photo-induced charge separation spectra and charge recombination kinetics in solution. 99
Folding propensity and biological activity of peptides: The effect of a single stereochemical isomerization on the conformational properties of bombinins in aqueous solution 98
Conformational and electronic properties of a microperoxidase in aqueous solution: a computational study 97
Folding propensity of anoplin: A molecular dynamics study of the native peptide and four mutated isoforms 96
Alternative Electron-Transfer Channels Ensure Ultrafast Deactivation of Light-Induced Excited States in Riboflavin Binding Protein 96
A theoretical modeling of the valence UV spectra of 1,2,3-triazine and uracil in solution 95
Extension of the Perturbed Matrix Method: application to a water molecule 95
A few key residues determine the high redox potential shift in azurin mutants 95
Structural and dynamical properties of KTS-disintegrins: a comparison between Obtustatin and Lebestatin 93
Quantitative structure-retention relationships of pesticides in reversed-phase high-performance liquid chromatography 93
Theoretical modeling of the absorption spectrum of aqueous riboflavin 93
Structure and Reactivity of Protonated Trifluoro Toluene in the Gas Phase. A Combined FT-ICR, Radiolytic and Ab Initio MO Study. 92
Theoretical modeling of UV-Vis absorption and emission spectra in liquid state systems including vibrational and conformational effects: The vertical transition approximation 91
Kinetic profile and molecular dynamic studies show that Y229W substitution in an NDM-1/L209F variant restores the hydrolytic activity of the enzyme toward penicillins, cephalosporins, and carbapenems 91
Probing Gaseous Ion-Molecule Complexes with Chiral Agents: the Reaction of Arenium Ions with R-(-)-s-Butylchloride. 89
Experimental Study on the Mechanism of Gas Phase Aromatic Nitration by Protonated Methyl Nitrate. 89
On the catalytic role of structural fluctuations in enzyme reactions: computational evidence on the formation of compound 0 in horseradish peroxidase. 89
The P-113 peptide: new experimental evidences on its biological activity and conformational insights from Molecular Dynamics simulations. 89
Theoretical study of intramolecular charge transfer in π-conjugated oligomers 89
Pd-catalyzed regioselective hydroarylation of α-(2-aminoaryl)-α,β-ynones with organoboron derivatives as a tool for the synthesis of quinolines: experimental evidence and quantum-chemical calculations 88
Protonated methyl nitrite. A theoretical investigation on the structure and stability of (MeO-NO)H+ and the proton affinity of RO-NO (R = H, Me) 87
Rhodium- and Palladium-Catalyzed Hydroarylation of Propargylic Amines with Arylboronic Acids 87
The addition of NF2+ to H2O as a route to gaseous protonated F2NOH. 87
Structure–Activity Relationship of novel phenylacetic CXCR1 inhibitors 87
Gold-Catalyzed Reactions of 2-Alkynyl-phenylamines with α,β-Enones 86
P174E substitution in GES-1 and GES-5 β-lactamases improves catalytic efficiency towards carbapenems. 86
Crystal Structure of the Peroxisome Proliferator-Activated Receptor gamma (PPAR gamma) Ligand Binding Domain Complexed with a Novel Partial Agonist: A New Region of the Hydrophobic Pocket Could Be Exploited for Drug Design. 86
Theoretical modeling of UV-Vis absorption and emission spectra in liquid state systems including vibrational and conformational effects: Explicit treatment of the vibronic transitions. 85
An Alternative Route to Electrophilic Substitution. 85
Chirality Transfer from a Single Chiral Molecule to 2D Superstructures in Alaninol on the Cu(100) Surface 84
Theoretical-computational modelling of infrared spectra in peptides and proteins: a new frontier for combined theoretical-experimental investigations 84
The role of Arginine 38 in Horseradish Peroxidase enzyme revisited: a computational investigation 84
Natural D240G Toho1 mutant conferring resistance to ceftazidime: biochemical characterization of CTX-M-43 84
A DFT study of the low-lying singlet excited states of the all-trans peridinin in vacuo 83
Experimental and Computational Study of Neutral Xenon Halides (XeX) in the Gas Phase for X=F, Cl, Br and I. 83
Gas Phase Proton Affinity of Nitric Acid and its Esters. A Mass Spectrometric and ab Initio Study on the Existence and the Relative Stability of Two Isomers of Protonated Ethyl Nitrate. 83
Structural insight into peroxisome proliferator-activated receptor gamma binding of two ureidofibrate-like enantiomers by molecular dynamics, cofactor interaction analysis and site-directed mutagenesis 83
UV Properties and Loading into Liposomes of Quinoline Derivatives 83
Supramolecular organization of chiral molecules on metallic surfaces: D-alaninol on Cu(100) as a case study 82
A theoretical study of alpha-84 phycocyanobilin chromophore from the thermophilic cyanobacterium synechococcus elongatus 82
Molecular dynamics simulation ofLeishmania major surface metalloprotease GP63 (leishmanolysin) 82
On the nature of solvatochromic effect: The riboflavin absorption spectrum as a case study 82
Theoretical prediction of thermodynamic equilibrium constants of chemical reactions in water 81
Toward a better understanding of steric stabilization when using block copolymers as stabilizers of single-walled carbon nanotubes (SWCNTs) aqueous dispersions 81
Spin-Forbidden Dehydrogenation of methoxy cation: a statistical view 80
Exploring the role of L209 residue in the active site of NDM-1 a metallo-β-lactamase 80
Dynamical aspects of TEM-1 β-Lactamase probed by molecular dynamics 80
The Singlet and Triplet State of phenyl cation. A hybrid approach for locating Minimum Energy Crossing Points between non-interaction potental energy surfaces 80
The role of disulfide bonds and N-terminus in the structural properties of hepcidins: insights from molecular dynamics simulations 79
Liposome destabilization by a 2,7-diazapyrenium derivative through formation of transient pores in the lipid bilayer 79
A fast redox-induced switching mechanism in a conformationally controllable molecular thread in solution 79
Flexible and Comprehensive Implementation of MD-PMM Approach in a General and Robust Code 78
Synthesis of 2‑Acylindoles via Ag- and Cu-Catalyzed anti-Michael Hydroamination of β‑(2-Aminophenyl)-α,β-ynones: Experimental Results and DFT Calculations. 78
Experimental results and computational insight into sequential reactions of β-(2-aminophenyl)-α,β-ynones with aryl isocyanates/benzoyl isothiocyanate 78
The Crafts-Friedel Reaction: Aromatic Alkylation within the Complex Formed upon Addition of a Gaseous Arenium Ion to an Olefin. 77
The Role of the Lifetime of Ion-Neutral Complexes in Gas Phase Electrophilic Aromatic Substitution. 77
Role of the amino sugar in the DNA binding of disaccharide anthracyclines: crystal structure of the complex MAR70/d(CGATCG) 77
Does Adsorption at Hydroxyapatite Surfaces Induce Peptide Folding? Insights from Large-Scale B3LYP Calculations 77
Peptides containing 4-amino-1,2-dithiolane-4-carboxylic acid (Adt): conformation of Boc-Adt-Adt-NHMe and NH?S interactions 76
Antimicrobial peptides: natural templates for synthetic membrane-active compounds 75
On the origin of IR spectral changes upon protein folding 75
Physico-chemical properties of fluorescent probes: experimental and computational determination of the overlapping pKa values of carboxyfluorescein 75
The Rate of the thermal reaction between S+ (4S) and CO (1Sigma). A computational study 75
Computational study of the catalytic domain of human neutrophil collagenase. Specific role of the S-3 and S '(3) subsites in the interaction with a phosphonate inhibitor 75
Trimethylsilylazide, an Efficient Trap for Gaseous Carbenium Ions. The azide-clock in the Gas Phase. 75
On the performance of time-dependent density functional theory and polarizable continuum model in the study of aqueous formaldehyde 75
Entropy-Energy Balance in Base Catalyzed Keto-Enol Interconversion: A Joint Theoretical and Experimental Investigation 74
A first-principle method to model perturbed electronic wavefunctions: the effect of an external homogeneous electric field 74
Evaluation of the Lifetime of Gaseous Ion Neutral Complexes. 2.The Rate of Isotopic Scrambling within Ethyl Ions as an Internal Clock. 74
Conformational behavior of temporin A and temporin L in aqueous solution: A computational/experimental study 74
On the reaction of ground-state nitrogen atoms with bromomethyl radicals: A computational study 73
Structural basis of the transactivation deficiency of the human PPARγ F360L mutant associated with familial partial lipodystrophy. 73
Gaseous Protonated Nitrosyl Fluoride. Experimental and Theoretical Characterization of Two Distingushable Isomers and Evaluation of The Barrier for Their Interconversion. 72
Thermodynamic features and environmental effects in a two-states molecular device under strict electrochemical control 72
Modelling of the effect of solute structure and mobile phase pH and composition on the retention of phenoxy acid herbicides in reversed-phase high-performance liquid chromatography 72
A Gas Phase Model for the Pt+-catalyzed Coupling of Methane and Ammonia. 72
Thermal and environmental effects on Oligothiophene low-energy singlet electronic excitations in dilute solution: a theoretical and experimental study 72
Fast stereoselective reactions in electrosprayed Co(ii)/neurotransmitter nanodroplets 72
Computational study of the reaction of N(2D) atoms with CH2F radicals: An example of a barrier-free reaction involving very high internal energies 72
Charge transfer equilibria of aqueous single stranded DNA 72
Reaction of β-(2-aminophenyl)-α,β-Ynones with Tosyl Isocyanate: Experimental and Computational Investigations 72
Experimental and computational evidence on gold-catalyzed regioselective hydration of phthalimido-protected propargylamines: an entry to β-amino ketones 72
Gas Phase Reactivity of Hydroxylamine Toward Charged Electrophiles. A Mass Spectrometric and Computational Study of the Protonation and Methylation of NH2OH. 71
Statistical mechanical modeling of chemical reactions in condensed phase systems 71
Theoretical modeling of chemical reactions in complex environments: The intramolecular proton transfer in aqueous malonaldehyde 71
Intramolecular charge transfer in π-conjugated oligomers: a theoretical study on the effect of temperature and oxidation state 71
Stereoselectivity by enantiomeric inhibitors of matrix metalloproteinase-8: new insights from molecular dynamics simulations 71
Gaseous Protonated Nitrosamide. A G2 Computational Study on the Structure, Stability and Interconversion of the Protonated Isomers. 70
Calculation of the Optical Rotatory Dispersion of solvated alanine by means oF the Perturbed Matrix Method 70
Extending the perturbed matrix method beyond the dipolar approximation: comparison of different levels of theory 70
On the importance of configurational sampling in theoretical calculation of electronic properties of complex molecular systems: acetone in water 69
Gas Phase Positive and Negative Ion Chemistry of Methyl Hydroperoxide. 69
Can a synthetic thread act as an electrochemical switchable molecular device? 69
Modelling vibrational relaxation in complex molecular systems 69
On the formation of horseradish peroxidase compound I at high pH: new insights from ab initio molecular dynamics 68
Totale 8.212
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Categoria #
all - tutte 58.552
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 58.552
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/2020165 0 0 0 0 0 0 0 0 0 0 8 157
2020/20211.343 7 157 1 160 157 47 223 3 192 46 302 48
2021/20221.119 54 98 170 60 28 13 20 216 60 7 66 327
2022/20233.346 263 190 140 291 316 364 6 222 1.397 10 100 47
2023/2024840 118 35 65 139 83 205 13 53 3 26 46 54
2024/20252.971 91 69 304 109 416 269 511 336 730 133 3 0
Totale 12.920