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The Journal of Chemical Physics|March 25, 2024
Extending the definition of atomic basis sets to atoms with fractional nuclear chargeGiorgio DomenichiniThe Journal of Chemical Physics|November 20, 2023
Molecular Hessian matrices from a machine learning random forest regression algorithmGiorgio Domenichini, Christoph DellagoThe Journal of Chemical Physics|May 14, 2022
Alchemical geometry relaxationGiorgio Domenichini, O Anatole von LilienfeldThe Journal of Chemical Physics|October 22, 2025
Alchemical diastereomers from antisymmetric alchemical perturbationsO Anatole von Lilienfeld, Giorgio DomenichiniThe Journal of Chemical Physics|October 22, 2020
Effects of perturbation order and basis set on alchemical predictionsGiorgio Domenichini, Guido Falk von Rudorff, O Anatole von LilienfeldACS Chemical Biology|June 8, 2018
Role of Gln222 in Photoswitching of Aequorea Fluorescent Proteins: A Twisting and H-Bonding Affair?Barbara Storti, Eleonora Margheritis, Gerardo Abbandonato, et al.Pageof 1