MANCINI, GIORDANO
 Distribuzione geografica
Continente #
EU - Europa 314
AS - Asia 46
NA - Nord America 44
SA - Sud America 2
AF - Africa 1
Totale 407
Nazione #
IT - Italia 178
IE - Irlanda 104
US - Stati Uniti d'America 44
VN - Vietnam 32
SE - Svezia 16
CZ - Repubblica Ceca 7
JP - Giappone 6
DE - Germania 5
IN - India 5
IR - Iran 3
PE - Perù 2
RU - Federazione Russa 2
CH - Svizzera 1
EG - Egitto 1
UA - Ucraina 1
Totale 407
Città #
Dublin 104
Milan 62
Pisa 36
Dong Ket 32
Voghera 25
Stockholm 16
Fleming Island 9
Scuola 9
Udine 8
Houston 7
Cusano Milanino 5
Bremen 4
Rome 4
Ann Arbor 3
Santa Maria a Monte 3
Brescia 2
Council Bluffs 2
Kasuga 2
Lima 2
Naples 2
Tappahannock 2
Waltham 2
Arlesheim 1
Bani Mazar 1
Bologna 1
Doiwala 1
Florence 1
Indore 1
Lecco 1
Manhattan 1
Mestre 1
Norfolk 1
Padova 1
Philadelphia 1
Seattle 1
Tokyo 1
Vellore 1
Westport 1
Woodbridge 1
Wuppertal 1
Totale 359
Nome #
The Italian National Project of Astrobiology - Life in Space - Origin, Presence, Persistence of Life in Space, from Molecules to Extremophiles, file e3aacdfe-75fd-4c98-e053-3705fe0acb7e 36
Breaking the Hydrophobicity of the MscL Pore: Insights into a Charge-Induced Gating Mechanism, file e3aacdfe-24d8-4c98-e053-3705fe0acb7e 31
Unsupervised search of low-lying conformers with spectroscopic accuracy: A two-step algorithm rooted into the island model evolutionary algorithm, file 1ea68cb7-7737-4111-9d3a-6d17d54f8cd9 24
Electronic absorption spectra of pyridine and nicotine in aqueous solution with a combined molecular dynamics and polarizable QM/MM approach, file e3aacdfe-2ea0-4c98-e053-3705fe0acb7e 23
Immersive virtual reality in computational chemistry: Applications to the analysis of QM and MM data, file e3aacdfe-3404-4c98-e053-3705fe0acb7e 23
4-Fluoro-Threonine: From Diastereoselective Synthesis to pH-Dependent Conformational Equilibrium in Aqueous Solution, file e3aacdfe-7e4f-4c98-e053-3705fe0acb7e 22
Unbiased disentanglement of conformational baths with the help of microwave spectroscopy, quantum chemistry and artificial intelligence: the puzzling case of homocysteine, file ca16f987-0388-47ed-854f-f68939273d6b 20
Tailor-made computational protocols for precise characterization of small biological building blocks using QM and MM approaches, file e3aacdfe-1470-4c98-e053-3705fe0acb7e 20
Computational Spectroscopy in Solution by Integration of Variational and Perturbative Approaches on Top of Clusterized Molecular Dynamics, file e3aacdfe-7f5a-4c98-e053-3705fe0acb7e 18
Diving into chemical bonding: An immersive analysis of the electron charge rearrangement through virtual reality, file e3aacdfe-1ee0-4c98-e053-3705fe0acb7e 17
Chemical promenades: Exploring potential-energy surfaces with immersive virtual reality, file e3aacdfe-23bd-4c98-e053-3705fe0acb7e 17
Fine-tuning of atomic point charges: classical simulations of pyridine in different environments, file e3aacdfe-1cb1-4c98-e053-3705fe0acb7e 16
Elusive Coordination of the Ag+Ion in Aqueous Solution: Evidence for a Linear Structure, file e3aacdfe-7604-4c98-e053-3705fe0acb7e 16
Integration of Quantum Chemistry, Statistical Mechanics, and Artificial Intelligence for Computational Spectroscopy: The UV–Vis Spectrum of TEMPO Radical in Different Solvents, file ca697f88-5aec-4bbf-9f5b-ccaf07347fc1 14
Assessment of Multi-Scale Approaches for Computing UV-Vis Spectra in Condensed Phases: Toward an Effective yet Reliable Integration of Variational and Perturbative QM/MM Approaches, file e3aacdfe-7494-4c98-e053-3705fe0acb7e 14
Tuning of dye optical properties by environmental effects: a QM/MM and experimental study, file e3aacdfe-83a0-4c98-e053-3705fe0acb7e 12
Molecular Perception for Visualization and Computation: The Proxima Library, file e3aacdfe-7f5c-4c98-e053-3705fe0acb7e 11
Unsupervised search of low-lying conformers with spectroscopic accuracy: A two-step algorithm rooted into the island model evolutionary algorithm, file e3aacdfe-79b6-4c98-e053-3705fe0acb7e 10
Fast exploration of Potential Energy Surfaces with a joint venture of Quantum Chemistry, Evolutionary Algorithms and Unsupervised Learning, file a8098f49-d989-4980-a638-20ce5fb07ca3 9
Molecular dynamics simulations enforcing nonperiodic boundary conditions: new developments and application to the solvent shifts of nitroxide magnetic parameters, file b2bee6ff-1b73-4274-969b-3aa07673175b 9
Development, validation, and pilot application of a generalized fluctuating charge model for computational spectroscopy in solution, file cd175477-7cd2-4c52-89b8-3d5b0717f941 9
Towards the SMART workflow system for computational spectroscopy, file e3aacdfe-1631-4c98-e053-3705fe0acb7e 6
Erratum: The Italian national project of astrobiology-life in space-origin, presence, persistence of life in space, from molecules to extremophiles (Astrobiology (2020) 20:5 (580-582) DOI: 10.1089/ast.2020.2247), file e3aacdfe-7823-4c98-e053-3705fe0acb7e 6
Integration of theory, simulation, artificial intelligence and virtual reality: A four-pillar approach for reconciling accuracy and interpretability in computational spectroscopy, file e3aacdfe-7ecb-4c98-e053-3705fe0acb7e 5
Systematic Study on the Absorption Features of Interstellar Ices in the Presence of Impurities, file e3aacdfe-7601-4c98-e053-3705fe0acb7e 4
Analysis of L-DOPA and droxidopa binding to human β2-adrenergic receptor, file e3aacdfe-7bbf-4c98-e053-3705fe0acb7e 4
Diving into chemical bonding: An immersive analysis of the electron charge rearrangement through virtual reality, file e3aacdfe-1ee1-4c98-e053-3705fe0acb7e 3
Tailor-made computational protocols for precise characterization of small biological building blocks using QM and MM approaches, file e3aacdfe-1632-4c98-e053-3705fe0acb7e 2
Force Field Parametrization of Metal Ions from Statistical Learning Techniques, file e3aacdfe-1a9f-4c98-e053-3705fe0acb7e 2
Deciphering Copper Coordination in the Mammalian Prion Protein Amyloidogenic Domain, file e3aacdfe-7bc4-4c98-e053-3705fe0acb7e 2
Structural and dynamical properties of the Hg2+ aqua ion: a molecular dynamics study, file 94036375-3cbf-479e-87ca-d0ab94859213 1
Cherry-picking functionally relevant substates from long md trajectories using a stratified sampling approach, file e3aacdfe-7608-4c98-e053-3705fe0acb7e 1
Totale 407
Categoria #
all - tutte 643
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 643


Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/202140 0000 00 06 02032
2021/202232 0190 40 12 21012
2022/2023335 53142347 2112 2524 116000
Totale 407