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Journal of Applied Crystallography|August 6, 2025
Inversion of the X-ray restrained wavefunction equations: a first step towards the development of exchange-correlation functionals based on X-ray dataAlessandro Genoni, Maurizio Sironi
The Journal of Physical Chemistry. A|October 20, 2018
Libraries of Extremely Localized Molecular Orbitals. 3. Construction and Preliminary Assessment of the New DatabanksBenjamin Meyer, Alessandro Genoni
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials|June 18, 2024
Current developments and trends in quantum crystallographyAnna Krawczuk, Alessandro Genoni
Physical Chemistry Chemical Physics : PCCP|October 11, 2023
Molecular dynamics investigation of benzoic acid in confined spacesLuca Sironi, Giovanni Macetti, Leonardo Lo Presti
Journal of Computational Chemistry|January 10, 2018
Spin density accuracy and distribution in azido Cu(II) complexes: A source function analysisGiovanni Macetti, Leonardo Lo Presti, Carlo Gatti
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials|June 13, 2022
Remarks on X-ray constrained/restrained wavefunction fittingHans Beat Bürgi, Alessandro Genoni
The Journal of Chemical Physics|June 20, 2024
Critical assessment of the x-ray restrained wave function approach: Advantages, drawbacks, and perspectives for density functional theory and periodic ab initio calculationsAlessandro Genoni, Ángel Martín Pendás
Organic & Biomolecular Chemistry|February 20, 2024
Alkene carboamination/oxidative denitrogenation of 3-allyl-3-hydrazinylindolin-2-ones: one-pot entry to spirocyclopropyloxindolesMarco Manenti, Tommaso Villa, Giovanni Macetti, et al.
The Journal of Physical Chemistry. B|March 6, 2012
Identification of domains in protein structures from the analysis of intramolecular interactionsAlessandro Genoni, Giulia Morra, Giorgio Colombo
Journal of Computational Chemistry|April 23, 2018
An Electron Density Source-Function Study of DNA Base Pairs in Their Neutral and Ionized Ground States<sup>†</sup>Carlo Gatti, Giovanni Macetti, Russell J Boyd, et al.
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