UNICA IRIS Institutional Research Information System

MALLOCI, GIULIANO
 Distribuzione geografica
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Continente #
EU - Europa 130.166
NA - Nord America 6.305
AS - Asia 979
AF - Africa 13
OC - Oceania 13
Continente sconosciuto - Info sul continente non disponibili 6
SA - Sud America 2
Totale 137.484
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Nazione #
IT - Italia 128.515
US - Stati Uniti d'America 6.278
CN - Cina 663
UA - Ucraina 547
SE - Svezia 500
DE - Germania 202
SG - Singapore 155
FI - Finlandia 145
GB - Regno Unito 141
VN - Vietnam 56
FR - Francia 34
IN - India 28
KR - Corea 22
CA - Canada 21
IL - Israele 17
AU - Australia 13
BE - Belgio 13
RU - Federazione Russa 13
ES - Italia 12
NL - Olanda 10
CZ - Repubblica Ceca 9
JP - Giappone 8
EU - Europa 6
IQ - Iraq 6
PL - Polonia 5
CM - Camerun 4
DZ - Algeria 4
IR - Iran 4
CH - Svizzera 3
HK - Hong Kong 3
IE - Irlanda 3
SN - Senegal 3
TR - Turchia 3
TW - Taiwan 3
CY - Cipro 2
EE - Estonia 2
GR - Grecia 2
LI - Liechtenstein 2
MX - Messico 2
RO - Romania 2
TH - Thailandia 2
AM - Armenia 1
AT - Austria 1
BG - Bulgaria 1
BH - Bahrain 1
BR - Brasile 1
CI - Costa d'Avorio 1
CR - Costa Rica 1
EC - Ecuador 1
EG - Egitto 1
GT - Guatemala 1
HU - Ungheria 1
ID - Indonesia 1
LV - Lettonia 1
MY - Malesia 1
NO - Norvegia 1
PA - Panama 1
PH - Filippine 1
PK - Pakistan 1
PR - Porto Rico 1
QA - Qatar 1
RS - Serbia 1
Totale 137.484
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Città #
Cagliari 127.794
Woodbridge 751
Fairfield 749
Chandler 622
Houston 569
Ashburn 475
Ann Arbor 348
Nyköping 347
Seattle 344
Wilmington 318
Cambridge 291
Jacksonville 245
Dearborn 174
Boardman 162
Boston 102
Nanjing 102
Shanghai 92
Beijing 86
Helsinki 72
Singapore 56
Redwood City 55
Dong Ket 54
New York 50
San Diego 42
Sassari 39
Nanchang 38
Changsha 34
Guangzhou 34
Jiaxing 32
Shenyang 31
Los Angeles 26
Washington 26
Mountain View 25
Hebei 24
Zhengzhou 23
Milan 21
Seoul 20
Norwalk 19
Tianjin 18
London 16
Azor 15
Jinan 15
Rome 15
Norman 14
Phoenix 14
Pune 14
Brussels 12
Taizhou 11
Fonni 10
Orange 10
Falls Church 9
Napoli 9
Ningbo 9
Toronto 9
Verona 9
Wuhan 9
Hefei 8
Kunming 8
Ottawa 8
Atlanta 7
Auburn Hills 7
Brno 7
Chicago 7
Columbus 7
Madrid 7
Hounslow 6
Kilburn 6
Munich 6
Fuzhou 5
Selargius 5
Torre del Greco 5
Baghdad 4
Genoa 4
Ghiffa 4
Hangzhou 4
Iglesias 4
Indiana 4
Perth 4
Redmond 4
Sinnai 4
Southwark 4
Walnut 4
Amsterdam 3
Assèmini 3
Baltimore 3
Bollate 3
Borås 3
Brisbane 3
Canelli 3
Casamicciola Terme 3
Chongqing 3
Dallas 3
Dublin 3
Edinburgh 3
Elsdorf 3
Fremont 3
Jesolo 3
Jinhua 3
Lund 3
Nürnberg 3
Totale 134.707
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Nome #
A database of force-field parameters, dynamics, and properties of antimicrobial compounds 3.717
Multidrug efflux pumps and their inhibitors characterized by computational modeling 3.361
Extracting conformational ensembles of small molecules from molecular dynamics simulations: ampicillin as a test case 3.077
Exploiting the porin pathway for polar compound delivery into Gram-negative bacteria 3.050
Electronic and optical properties of functionalized polyaromatic hydrocarbons: a computational investigation on perfluorinated circumacenes 3.015
Rationalizing the permeation of polar antibiotics into Gram-negative bacteria 2.888
Bacterial outer membrane porins as electrostatic nanosieves: exploring transport rules of small polar molecules 2.821
Computational investigation of the effects of perfluorination on the charge-transport properties of polyaromatic hydrocarbons 2.820
Computer simulations of the activity of RND efflux pumps 2.683
Water-mediated interactions enable smooth substrate transport in a bacterial efflux pump 2.639
Molecular Rationale behind the Differential Substrate Specificity of Bacterial RND Multi-Drug Transporters 2.638
Molecular Modeling of Multidrug Properties of Resistance Nodulation Division (RND) Transporters 2.611
Computational modelling of efflux pumps and their inhibitors 2.588
A New Critical Conformational Determinant of Multidrug Efflux by an MFS Transporter 2.508
Molecular Interactions of Cephalosporins with the Deep Binding Pocket of the RND Transporter AcrB 2.463
Molecular Determinants of the Promiscuity of MexB and MexY Multidrug Transporters of Pseudomonas aeruginosa 2.462
Complexes formed by the siderophore-based monosulfactam antibiotic BAL30072 and their interaction with the outer membrane receptor PiuA of P. aeruginosa 2.373
Electronic and optical properties of hexathiapentacene in the gas and crystal phases 2.356
Identification and characterization of carbapenem binding sites within the RND-transporter AcrB 2.326
Coding for physics 2.325
Effects of substitution and functionalization on the electronic, optical, and transport properties of polycyclic aromatic hydrocarbons 2.240
Effects of TIPS-Functionalization and Perhalogenation on the Electronic, Optical, and Transport Properties of Angular and Compact Dibenzochrysene 2.229
Computational investigation on the effect of halogen substitution on the electronic, optical, and transport properties of guanine 2.168
Filtering with the electric field: a story on protein channels electrostatics 2.019
The complex of ferric-enterobactin with its transporter from Pseudomonas aeruginosa suggests a two-site model 1.992
Tuning optical properties of dibenzochrysenes by functionalization: A many-body perturbation theory study 1.964
Binding and Transport of Carboxylated Drugs by the Multidrug Transporter AcrB 1.852
The challenge of intracellular antibiotic accumulation, a function of fluoroquinolone influx versus bacterial efflux 1.787
Investigation of siderophore-monobactam antibiotic derivatives: their iron(III)-complexes and binding to receptors 1.778
Electronic properties and quantum confinement in Bi2S3 ribbon-like nanostructures 1.746
Computational investigation on the electronic, optical and transport properties of hexathiapentacene in the molecular and solid phases 1.740
Molecular interactions of carbapenem antibiotics with the multidrug efflux transporter acrb of escherichia coli 1.688
Chlorpromazine and amitriptyline are substrates and inhibitors of the acrb multidrug efflux pump 1.495
Holo-like and Druggable Protein Conformations from Enhanced Sampling of Binding Pocket Volume and Shape 1.393
Interfacial Engineering of P3HT/ZnO Hybrid Solar Cells Using Phthalocyanines: A Joint Theoretical and Experimental Investigation 1.374
The Role Functionalizations on the Electronic and Optical Properties of Angular and Compact Dibenzochrysene 1.352
Optoelectronic properties of (ZnO)_60 isomers 1.342
Coupling enhanced sampling of the apo-receptor with template-based ligand conformers selection: performance in pose prediction in the D3R Grand Challenge 4 1.319
Time-Dependent Density Functional Theory Investigation on the Electronic and Optical Properties of Poly-C,Si,Ge-acenes 1.301
A (time-dependent) density functional theory study of the optoelectronic properties of bis-triisopropylsilylethynyl-functionalized acenes 1.266
Angular and Compact Dibenzochrysene: the Role of Functionalizations on their Electronic and Optical Properties 1.176
Electronic properties of hybrid Zinc Oxide - Oligothiophene nanostructures 1.175
Z-Selective Synthesis of α-Sulfanyl Carbonyl Compounds from Internal Alkynes and Thiols via Photoredox Catalysis 1.146
Perturbed structural dynamics underlie inhibition and altered efflux of the multidrug resistance pump AcrB 1.144
Electronic Excitations and Optical Properties of Angular and Compact Dibenzochrysene and their Derivatives 1.081
Electronic and Optical properties of Hexathiapentacene within TD(DFT) schemes 1.072
The effect of selective interactions at the interface of polymer-oxide hybrid solar cells 1.071
Atomistic simulations of thiol-terminated modifiers for hybrid photovoltaic interfaces 1.054
Polycyclic aromatic hydrocarbons and the extinction curve 1.040
Predictive rules of efflux inhibition and avoidance in Pseudomonas aeruginosa 1.038
Dehydrogenated polycyclic aromatic hydrocarbons and UV bump 939
Polymer crystallinity and transport properties at the poly3-hexylthiophene/ZincPxide interface 931
The role of the charge state of PAHs in ultraviolet extinction 920
Electronic and optical properties of TIPS-substituted pentacene: a(time dependent) density functional theory study 919
Zinc Oxide-Zinc Phthalocyanine interface for Hybrid Solar Cells 894
OACagliari VAMDC QChITool Software 843
Bacterial efflux transporters’ polyspecificity – a gift and a curse? 837
Electronic and optical properties of families of polycyclic aromatic hydrocarbons: A systematic (time-dependent) density functional theory study 830
A framework for dissecting affinities of multidrug efflux transporter AcrB to fluoroquinolones 774
Electronic and Optical of PAH families: a (time dependent) DFT study 773
Role of molecular thermodynamical processes at functionalized polymer/metaloxide interfaces for photovoltaics 770
Antimicrobial compounds database 724
Structural and optoelectronic properties of unsaturated ZnO and ZnS nanoclusters 698
Impact of corpus callosum integrity on functional interhemispheric connectivity and cognition in healthy subjects 685
Time-dependent density functional study of the electronic spectra of oligoacenes in the charge states -1, 0, +1, and +2 680
Electronic excitations of oligoacenes: A time dependent density functional theory study 676
Electronic excitations in homologous classes of PAHs 654
AB-DB: Force-Field parameters, MD trajectories, QM-based data, and Descriptors of Antimicrobials 651
Fullerene-like III-V Binary Compounds 647
Search for far-IR PAH bands with Herschel: Modelling and observational approaches 599
Electronic excitations in homologous classes of PAH's for applications in photonics and electronics 596
Molecular simulations of SSTR2 dynamics and interaction with ligands 595
Optical absorption and electronic properties polycyclic aromatic hydrocarbons 585
Pyridylpiperazine-based allosteric inhibitors of RND-type multidrug efflux pumps 574
Theoretical electron affinities of PAHs and electronic absorption spectra of their mono-anions 543
Molecular insights into the Patched1 drug efflux inhibitory activity of panicein A hydroquinone: a computational study 532
Photoabsorption spectra of small fullerenes via time-dependent density functional calculations 525
Quasiparticle energies and optical properties of small fullerenes 523
Search for corannulene (C 20H 10) in the Red Rectangle 523
Molecular rationale for the impairment of the MexAB-OprM efflux pump by a single mutation in MexA 512
Electronic and optical properties of oligoacenes in four different charge states:-1,0, +1 and +2 503
Dehydrogenated coronene cations and interstellar extinction 501
Visible photodissociation spectroscopy of PAH cations and derivatives in the PIRENEA experiment 498
Electronic excitations of oligoacenes in four different charge states:-1,0,+1 and +2 491
Inhibition of the drug efflux activity of Ptch1 as a promising strategy to overcome chemotherapy resistance in cancer cells 466
Modeling peculiar extinction curves 462
Theoretical evaluation of PAH dication properties 442
Recognition of quinolone antibiotics by the multidrug efflux transporter MexB of Pseudomonas aeruginosa 439
Structural and functional analysis of the promiscuous AcrB and AdeB efflux pumps suggests different drug binding mechanisms 424
Common recognition topology of mex transporters of Pseudomonas aeruginosa revealed by molecular modelling 423
Testing the attribution of selected DIBs to dehydrogenated coronene cations 418
Quasiparticle Effects and optical absorption in small fullerene-like GaP clusters 416
High-resolution infrared absorption spectroscopy of thermally excited naphthalene. Measurements and calculations of anharmonic parameters and vibrational interactions 412
null 401
Mechanistic Duality of Bacterial Efflux Substrates and Inhibitors: Example of Simple Substituted Cinnamoyl and Naphthyl Amides 397
Large prebiotic molecules in space: Photophysics of acetic acid and its isomers 384
On-line database of the spectral properties of polycyclic aromatic hydrocarbons 382
null 375
Efficient calculation of van der Waals dispersion coefficients with time-dependent density functional theory in real time: Application to polycyclic aromatic hydrocarbons 374
Estimated IR and phosphorescence emission fluxes for specific polycyclic aromatic hydrocarbons in the Red Rectangle 370
Totale 129.293
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Categoria #
all - tutte 170.564
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 170.564
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/202024.162 0 990 175 514 9.585 6.344 3.207 741 531 677 456 942
2020/202137.250 1.272 1.544 1.554 10.441 7.373 3.860 2.733 2.215 967 2.188 1.788 1.315
2021/20229.053 1.170 890 416 499 828 656 493 393 664 939 1.144 961
2022/202315.864 1.091 1.888 1.667 1.300 1.351 1.945 814 1.004 1.053 1.154 1.762 835
2023/202416.206 568 587 713 889 1.417 2.651 2.257 1.457 867 1.019 1.848 1.933
2024/20258.542 6.248 2.294 0 0 0 0 0 0 0 0 0 0
Totale 137.877