MACETTI, GIOVANNI
MACETTI, GIOVANNI
Dipartimento di Chimica
Innovative On-Resin and in Solution Peptidomimetics Synthesis via Metal-Free Photocatalytic Approach
2024 T. Gandini, F. Vaghi, Z. Laface, G. Macetti, A. Bossi, M. Penconi, M.L. Gelmi, R. Bucci
Study of pre-nucleation clusters of liquid benzoic acid by molecular dynamics simulations
2024 L. Sironi, G. Macetti, L. Lo Presti
Subcritical clusters of liquid benzoic acid: insights from molecular dynamics simulations
2024 L. Sironi, G. Macetti, L. Lo Presti
Pre-nucleation clusters in liquid benzoic acid
2024 L. Sironi, G. Macetti, L. Lo Presti
Symmetry-constrained Monte Carlo to predict the experimental crystal structure of small organic molecules
2024 G. Macetti, L. Sironi, L. LO PRESTI
Alkene carboamination/oxidative denitrogenation of 3-allyl-3-hydrazinylindolin-2-ones: one-pot entry to spirocyclopropyloxindoles
2024 M. Manenti, T. Villa, G. Macetti, A. Silvani
Doubly Metathetic NiCl2-Catalyzed Coupling Between Bis(2-oxazolines) and Aldehydes: A Novel Access to Bis(ester-imine) Derivatives
2024 C. Sara, J. Oble, G. Poli, L. LO PRESTI, G. Macetti, A. Contini, G. Broggini, M. Papis, C. Loro
Symmetry-constrained Monte Carlo to predict the experimental crystal structures of small organic molecules
2023 G. Macetti, L. Sironi, L. LO PRESTI
Extracting Quantitative Information at Quantum Mechanical Level from Noncovalent Interaction Index Analyses
2023 E.K. Wieduwilt, R.A. Boto, G. Macetti, R. Laplaza, J. Contreras-Garcia, A. Genoni
Milano Chemistry Molecular Simulation (MiCMoS): a versatile tool to study molecular systems in condensed phase
2023 L. Sironi, G. Macetti, L. LO PRESTI
Molecular Dynamics Simulations of Small Organic Molecules in Confined Spaces
2023 L. Sironi, G. Macetti, L. LO PRESTI
Study of molecular recognition of supercooled benzoic acid with MiCMoS
2023 L. Sironi, G. Macetti, L. LO PRESTI
Monte Carlo simulations of electron interactions with the DNA molecule: A complete set of physics models for Geant4-DNA simulation toolkit
2023 S.A. Zein, M. Bordage, H. Ngoc Tran, G. Macetti, A. Genoni, C. Dal Cappello, S. Incerti
Initial Maximum Overlap Method Embedded with Extremely Localized Molecular Orbitals for Core-Ionized States of Large Systems
2023 G. Macetti, A. Genoni
Classical Molecular Dynamics Simulation of Molecular Crystals and Materials: Old Lessons and New Perspectives
2023 G. Macetti, L. Sironi, L. Lo Presti
Introduction of a weighting scheme for the X-ray restrained wavefunction approach: advantages and drawbacks
2023 G. Macetti, A. Genoni
Molecular dynamics investigation of benzoic acid in confined spaces
2023 L. Sironi, G. Macetti, L. LO PRESTI
Quantum mechanics/extremely localized molecular orbital embedding technique: Theoretical foundations and further validation
2021 G. Macetti, A. Genoni
Electron transport in DNA bases: An extension of the Geant4-DNA Monte Carlo toolkit
2021 S.A. Zein, M.-. Bordage, Z. Francis, G. Macetti, A. Genoni, C. Dal Cappello, W.-. Shin, S. Incerti
X-ray restrained extremely localized molecular orbitals for the embedding of quantum mechanical calculations
2021 G. Macetti, P. Macchi, A. Genoni