GENONI, ALESSANDRO

GENONI, ALESSANDRO  

DIPARTIMENTO DI CHIMICA, MATERIALI E INGEGNERIA CHIMICA "GIULIO NATTA"  

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Risultati 1 - 20 di 62 (tempo di esecuzione: 0.023 secondi).
Titolo Data di pubblicazione Autori File
A first-prototype multi-determinant X-ray constrained wavefunction approach: The X-ray constrained extremely localized molecular orbital-valence bond method 1-gen-2017 Genoni A.
A Hylleraas functional based perturbative technique to relax the extremely localized molecular orbital wavefunction 1-gen-2008 Genoni A. +
A novel approach to relax extremely localized molecular orbitals: The extremely localized molecular orbital-valence bond method 1-gen-2004 Genoni A. +
A novel extremely localized molecular orbitals based technique for the one-electron density matrix computation 1-gen-2005 Genoni A. +
A valence bond description of the bromine halogen bond 1-gen-2019 Genoni A. +
Accurate crystal structures and chemical properties from NoSpherA2 1-gen-2021 Genoni A. +
Atomic level description of the protecting effect of osmolytes against thermal denaturation of proteins 1-gen-2007 Genoni A. +
Climbing Jacob's Ladder of Structural Refinement: Introduction of a Localized Molecular Orbital-Based Embedding for Accurate X-ray Determinations of Hydrogen Atom Positions 1-gen-2021 Genoni A. +
Complementary bonding analysis of the N-Si interaction in pentacoordinated silicon compounds using quantum crystallography 1-gen-2019 Genoni A. +
Computational study of the resistance shown by the subtype B/HIV-1 protease to currently known inhibitors 1-gen-2010 Genoni A. +
Critical assessment of the x-ray restrained wave function approach: Advantages, drawbacks, and perspectives for density functional theory and periodic ab initio calculations 1-gen-2024 Genoni A. +
DENPOL: A new program to determine electron densities of polypeptides using extremely localized molecular orbitals 1-gen-2009 Genoni A. +
Electron transport in DNA bases: An extension of the Geant4-DNA Monte Carlo toolkit 1-gen-2021 Genoni A. +
Elucidating the nature of chemical bonds in a coordination compound through quantum crystallographic techniques 1-gen-2023 Genoni A.
Extracting Quantitative Information at Quantum Mechanical Level from Noncovalent Interaction Index Analyses 1-gen-2023 Genoni A. +
Extremely localized molecular orbitals: Theory and applications 1-gen-2007 Genoni A. +
Fast and Accurate Quantum Crystallography: From Small to Large, from Light to Heavy 1-gen-2019 Genoni A. +
Halogenation of the N-Terminus Tyrosine 10 Promotes Supramolecular Stabilization of the Amyloid-beta Sequence 7-12 1-gen-2020 Maiolo D.Pizzi A.Gori A.Gazzera L.Genoni A.Terraneo GBaldelli Bombelli F.Metrangolo P.Resnati G. +
Identification of domains in protein structures from the analysis of intramolecular interactions 1-gen-2012 Genoni A. +
In vivo and in silico evaluation of a new nitric oxide donor, S,S′-dinitrosobucillamine 1-gen-2017 Genoni A. +