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Mostrati risultati da 906 a 925 di 1.943
Titolo Data di pubblicazione Autori Tipo File
Integrated Multiscale Multilevel Approach to Open Shell Molecular Systems 2023 Giovannini, TommasoMarrazzini, GioiaScavino, MarcoKoch, HenrikCappelli, Chiara 1.1 Articolo in rivista
Integrated NMR and computational study of push-pull NLO probes: interplay of solvent and structural effects 2011 Marini, AlbertoMacchi, SaraMennucci, Benedetta + 1.1 Articolo in rivista
Integrated QM/MM approaches to the study of structure, dynamics and optical properties of molecules in complex environments 2015 DE MITRI, NICOLA 9.1 Tesi PhD
Integrated QM/polarizable MM/continuum approaches to model chiroptical properties of strongly interacting solute-solvent systems 2016 CAPPELLI, Chiara 1.1 Articolo in rivista
Integration of Quantum Chemistry, Statistical Mechanics, and Artificial Intelligence for Computational Spectroscopy: The UV–Vis Spectrum of TEMPO Radical in Different Solvents 2022 Falbo, EmanueleLazzari, FedericoMancini, GiordanoBarone, Vincenzo + 1.1 Articolo in rivista
Integration of theory, simulation, artificial intelligence and virtual reality: A four-pillar approach for reconciling accuracy and interpretability in computational spectroscopy 2021 Barone V.Puzzarini C.Mancini G. 1.1 Articolo in rivista
Interaction of anthralin with cysteine: a new entry into the chemistry of biologically active anthrones 1984 M. D'ISCHIA + 1.1 Articolo in rivista
INTERACTION OF CARBON-ATOMS WITH THE BASAL-PLANE OF GRAPHITE - A THEORETICAL-STUDY OF THE CHEMISORPTION ON MODEL FINITE CLUSTER COMPOUNDS 1987 BARONE, Vincenzo + 1.1 Articolo in rivista
Interaction of collagen with chlorosulphonated paraffin tanning agents: Fourier transform infrared spectroscopic analysis and molecular dynamics simulations 2013 BARONE, Vincenzo + 1.1 Articolo in rivista
Interactions and reactivity in crystalline intermediates of mechanochemical cyclorhodation reactions 2024 Gómez, SaraCappelli, Chiara + 1.1 Articolo in rivista
Interactions between alkanes and aromatic molecules: A rotational study of pyridine-methane 2014 Spada, Lorenzo + 1.1 Articolo in rivista
Interactions between Carboxylic Acids and Heteroaromatics: A Rotational Study of Formic Acid-Pyridine 2016 Spada, Lorenzo + 1.1 Articolo in rivista
Interactions between freons and aromatic molecules: The rotational spectrum of pyridine-difluoromethane 2014 Spada, Lorenzo + 1.1 Articolo in rivista
Interactions between freons: A rotational study of CH2F2-CH2Cl2 2014 Spada, Lorenzo + 1.1 Articolo in rivista
Interactions in Solvents and Solutions 2000 CAPPELLI, Chiara + 2.1 Contributo in volume (Capitolo o Saggio)
Interactions of Nitric Oxide with Lipid Peroxidation Products under Aerobic Conditions: Inhibitory Effects on the Formation of Malondialdehyde and Related Thiobarbituric Acid-Reactive Substances 2000 M. D'ISCHIA + 1.1 Articolo in rivista
Interactions of Nucleotide Bases with Decorated Si Surfaces from Molecular Dynamics Simulations 2011 BARONE, Vincenzo + 1.1 Articolo in rivista
Intermolecular Hydrogen Bonding in 2-Fluoropyridine-Water 2016 Spada, Lorenzo + 1.1 Articolo in rivista
Intermolecular pi-Electron Perturbations Generate Extrinsic Visible Contributions to Eumelanin Black Chromophore in Model Polymers with Interrupted Interring Conjugation 2013 D'ISCHIA, MARCO + 1.1 Articolo in rivista
Internal dynamics in Halogen-Bonded adducts: A rotational study of chlorotrifluoromethane-formaldehyde 2015 Spada, Lorenzo + 1.1 Articolo in rivista
Mostrati risultati da 906 a 925 di 1.943
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