IRIS Institutional Research Information System - OPENBS Open Archive UniBS

FUSE', Marco
 Distribuzione geografica
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Continente #
NA - Nord America 737
AS - Asia 398
EU - Europa 276
AF - Africa 4
OC - Oceania 3
SA - Sud America 2
Totale 1.420
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Nazione #
US - Stati Uniti d'America 732
SG - Singapore 148
HK - Hong Kong 126
IT - Italia 59
TR - Turchia 58
CN - Cina 50
IE - Irlanda 50
FI - Finlandia 46
GB - Regno Unito 42
UA - Ucraina 30
DE - Germania 21
ID - Indonesia 10
BE - Belgio 8
SE - Svezia 5
CA - Canada 4
FR - Francia 4
BG - Bulgaria 3
ES - Italia 3
AU - Australia 2
CL - Cile 2
IN - India 2
JP - Giappone 2
NL - Olanda 2
CH - Svizzera 1
CI - Costa d'Avorio 1
CZ - Repubblica Ceca 1
DK - Danimarca 1
EG - Egitto 1
MA - Marocco 1
MU - Mauritius 1
NZ - Nuova Zelanda 1
PA - Panama 1
PK - Pakistan 1
VN - Vietnam 1
Totale 1.420
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Città #
Singapore 125
Hong Kong 124
Chandler 122
Princeton 96
Fairfield 78
Istanbul 57
Dublin 50
Woodbridge 39
Houston 34
Ashburn 29
Helsinki 29
Seattle 27
Ann Arbor 23
Cambridge 22
Jacksonville 21
Brescia 20
London 16
Lappeenranta 15
Wilmington 15
New York 13
Jakarta 10
San Diego 10
Lancaster 9
Brussels 8
Dearborn 6
West Jordan 6
Los Angeles 5
Changsha 4
Haikou 4
Milan 4
Beijing 3
Jinan 3
Romola 3
Shanghai 3
Toronto 3
Boardman 2
Chiswick 2
Council Bluffs 2
Dallas 2
Grassobbio 2
Jiaxing 2
Kunming 2
Nanjing 2
Rome 2
Secaucus 2
Shenyang 2
Southwark 2
Verona 2
Acton 1
Amsterdam 1
Arquata Scrivia 1
Bolton 1
Brooklyn 1
Canberra 1
Casalecchio di Reno 1
Clifton 1
Dalsjoefors 1
Damietta 1
Des Moines 1
Espoo 1
Frankfurt am Main 1
Gragnano 1
Groningen 1
Guangzhou 1
Hanoi 1
Hebei 1
Indiana 1
Islington 1
Kilburn 1
La Spezia 1
Leipzig 1
Livorno 1
Melbourne 1
Modesto 1
Mountain View 1
Nagpur 1
Nanchang 1
Nashville 1
Ningde 1
Nuremberg 1
Nuvolera 1
Oleggio 1
Olomouc 1
Orange 1
Paris 1
Parma 1
Portsmouth 1
Prescot 1
San Francisco 1
Santa Clara 1
Scuola 1
Settat 1
Stoney Creek 1
Strasbourg 1
Tokyo 1
Valencia 1
Valladolid 1
Walnut 1
Wandsworth 1
Washington 1
Totale 1.114
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Nome #
Vibrational circular dichroism and chiroptical properties of chiral Ir(iii) luminescent complexes 113
VCD spectroscopy as an excellent probe of chiral metal complexes containing a carbon monoxide vibrational chromophore 109
Luminescent water-soluble cycloplatinated complexes: structural, photophysical, electrochemical and chiroptical properties 100
1,2-Disubstituted Planar Chiral Ferrocene Derivatives from Sulfonamide-Directed ortho-Lithiation: Synthesis, Absolute Configuration, and Chiroptical Properties 85
Toward Fully Unsupervised Anharmonic Computations Complementing Experiment for Robust and Reliable Assignment and Interpretation of IR and VCD Spectra from Mid-IR to NIR: The Case of 2,3-Butanediol and trans-1,2-Cyclohexanediol 51
Unbiased Determination of Absolute Configurations by vis-à-vis Comparison of Experimental and Simulated Spectra: The Challenging Case of Diplopyrone 45
8-Amino-5,6,7,8-Tetrahydroquinolines as Ligands in Iridium(III) Catalysts for the Reduction of Aryl Ketones by asymmetric transfer hydrogenation (ATH) 31
Structure and Vibrationa Circular Dichroism (VCD) of luminescent Chiral Ir(III) complexes 31
Asymmetric Hydrogenation vs Transfer Hydrogenation in the Reduction of Cyclic Imines 29
Computational simulation of vibrationally resolved spectra for spin-forbidden transitions 27
Discovering the Elusive Global Minimum in a Ternary Chiral Cluster: Rotational Spectra of Propylene Oxide Trimer 27
Alternative Strategy to Obtain Artificial Imine Reductase by Exploiting Vancomycin/D-Ala-D-Ala Interactions with an Iridium Metal Complex 26
Accuracy meets interpretability for computational spectroscopy by means of hybrid and double-hybrid functionals 26
Chemical bonding in cuprous complexes with simple nitriles: Octet rule and resonance concepts: Versus quantitative charge-redistribution analysis 26
Diastereoselectivity and catalytic activity in ruthenium complexes chiral at the metal centre 24
Enantioselective transfer hydrogenation of aryl ketones: synthesis and 2D-NMR characterization of new 8-amino-5,6,7,8-tetrahydroquinoline Ru(II)-complexes 24
Insights into the Structures of Bilirubin and Biliverdin from Vibrational and Electronic Circular Dichroism: History and Perspectives 23
8-Amino-5,6,7,8-tetrahydroquinolines as ligands in iridium(III) catalysts for the reduction of aryl ketones by asymmetric transfer hydrogenation (ATH) 23
8-Amino-5,6,7,8-tetrahydroquinolines as ligands in iridium(III) catalysts for the reduction of aryl ketones by asymmetric transfer hydrogenation (ATH) 23
A computational journey across nitroxide radicals: From structure to spectroscopic properties and beyond 22
MCD and Induced CD of a Tetraphenoxyperylene-Based Dye in Chiral Solvents: An Experimental and Computational Study 21
Donor-acceptor properties of atropisomeric diphosphines in Nickel di-carbonyl and Rhodium-chloro-carbonyl complexes 21
Cascade Reaction by Chemo- and Biocatalytic Approaches to Obtain Chiral Hydroxy Ketones and anti 1,3-Diols 21
4-Fluoro-Threonine: From Diastereoselective Synthesis to pH-Dependent Conformational Equilibrium in Aqueous Solution 21
Simple 1,3-diamines and their application as ligands in ruthenium(ii) catalysts for asymmetric transfer hydrogenation of aryl ketones 21
Diastereoselectivity and catalytic activity in ruthenium complexes chiral at the metal centre 21
CPL Spectra of Camphor Derivatives in Solution by an Integrated QM/MD Approach 21
Luminescent chiral ionic Ir(III) complexes : synthesis and photophysical properties 19
Interplay of Stereoelectronic and Vibrational Modulation Effects in Tuning the UPS Spectra of Unsaturated Hydrocarbon Cage Compounds 19
Asymmetric hydrogenation of 1-aryl substituted-3,4-dihydroisoquinolines with iridium catalysts bearing different phosphorus-based ligands 18
Evaluation of chemical diversity of biotinylated chiral 1,3-diamines as a catalytic moiety in artificial imine reductase 18
Molecular Dynamics Simulations Enforcing Nonperiodic Boundary Conditions: New Developments and Application to the Solvent Shifts of Nitroxide Magnetic Parameters 17
Ruthenium(II) complexes bearing (NNN) ligand: Catalytic evaluation of different solvent-mediated coordination modes 17
Diving into chemical bonding: An immersive analysis of the electron charge rearrangement through virtual reality 17
Circularly polarized luminescence of natural products lycorine and narciclasine: role of excited-state intramolecular proton-transfer and test of pH sensitivity 17
Towards the SMART workflow system for computational spectroscopy 16
Anharmonic Aspects in Vibrational Circular Dichroism Spectra from 900 to 9000 cm-1 for Methyloxirane and Methylthiirane 16
Vibrational circular dichroism under the quantum magnifying glass: from the electronic flow to the spectroscopic observable 15
Simple 1,3-diamines and their application as ligands in ruthenium(II) catalysts for asymmetric transfer hydrogenation of aryl ketones 15
Benchmark Structures and Conformational Landscapes of Amino Acids in the Gas Phase: A Joint Venture of Machine Learning, Quantum Chemistry, and Rotational Spectroscopy 14
Luminescent chiral ionic Ir(III) complexes: Synthesis and photophysical properties 14
Synthesis and crystallographic structure of nickel(0) carbonyl complex with Bitianp, an atropoisomeric diphosphine 14
Luminescent Chiral Ionic Ir(III) Complexes: Synthesis and Photophysical Properties 14
The ONIOM/PMM Model for Effective Yet Accurate Simulation of Optical and Chiroptical Spectra in Solution: Camphorquinone in Methanol as a Case Study 14
Two-level stochastic search of low-energy conformers for molecular spectroscopy: Implementation and validation of MM and QM models 13
On the relation between carbonyl stretching frequencies and the donor power of chelating diphosphines in nickel dicarbonyl complexes 13
Theoretical Investigation of the Circularly Polarized Luminescence of a Chiral Boron Dipyrromethene (BODIPY) Dye 13
Scaling-up VPT2: A feasible route to include anharmonic correction on large molecules 12
Pushing measurements and interpretation of VCD spectra in the IR, NIR and visible ranges to the detectability and computational complexity limits 12
Fast exploration of potential energy surfaces with a joint venture of quantum chemistry, evolutionary algorithms and unsupervised learning 12
Unbiased disentanglement of conformational baths with the help of microwave spectroscopy, quantum chemistry, and artificial intelligence: The puzzling case of homocysteine 12
Enantioselective transfer hydrogenation of Aryl Ketones: Synthesis and 2D-NMR characterization of new 8-amino-5,6,7,8-tetrahydroquinoline Ru(II)-complexes 12
Integration of Quantum Chemistry, Statistical Mechanics, and Artificial Intelligence for Computational Spectroscopy: The UV-Vis Spectrum of TEMPO Radical in Different Solvents 11
Exploring the maze of cycloserine conformers in the gas phase guided by microwave spectroscopy and quantum chemistry 11
Evaluation of Chemical Diversity of Biotinylated Chiral 1,3-Diamines as a Catalytic Moiety in Artificial Imine Reductase 11
Experimental and theoretical aspects of magnetic circular dichroism and magnetic circularly polarized luminescence in the UV, visible and IR ranges: A review 11
Exploiting coordination geometry to selectively predict the r-donor and p-acceptor abilities of ligands: A back-and-forth journey between electronic properties and spectroscopy 10
New sp3diphosphine-based rhodium catalysts for the asymmetric conjugate addition of aryl boronic acids to 3-azaarylpropenones 10
Unsupervised search of low-lying conformers with spectroscopic accuracy: A two-step algorithm rooted into the island model evolutionary algorithm 10
Interplay of stereo-electronic, vibronic and environmental effects in tuning the chiroptical properties of an Ir(III) cyclometalated N-heterocyclic carbene 9
Accurate Structures and Spectroscopic Parameters of Phenylalanine and Tyrosine in the Gas Phase: A Joint Venture of DFT and Composite Wave-Function Methods 9
Bringing Machine-Learning Enhanced Quantum Chemistry and Microwave Spectroscopy to Conformational Landscape Exploration: the Paradigmatic Case of 4-Fluoro-Threonine 8
Mid‐IR and CH stretching vibrational circular dichroism spectroscopy to distinguish various sources of chirality: The case of quinophaneoxazoline based ruthenium(II) complexes 6
CPL of Mellein and Related Natural Compounds: Analysis of the ESIPT Phenomenon 5
Sigma receptor and aquaporin modulators: chiral resolution, configurational assignment, and preliminary biological profile of RC752 enantiomers 5
Totale 1.501
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Categoria #
all - tutte 21.294
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 21.294
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/202094 0 0 0 0 6 16 10 16 14 19 3 10
2020/202182 3 9 2 9 4 9 0 15 5 14 6 6
2021/2022235 2 6 3 10 0 2 0 106 8 12 7 79
2022/2023326 57 45 21 12 22 79 5 19 32 3 15 16
2023/2024332 24 19 11 36 8 20 3 9 125 13 7 57
2024/2025285 9 2 16 133 125 0 0 0 0 0 0 0
Totale 1.501