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Journal of Chemical Theory and Computation|November 27, 2015
Many-Body Perturbation Theory Extended to the Quantum Mechanics/Molecular Mechanics Approach: Application to Indole in Water SolutionAdriano Mosca Conte, Emiliano Ippoliti, Rodolfo Del Sole, et al.The Journal of Physical Chemistry Letters|May 5, 2021
Mechanisms Underlying Proton Release in CLC-type F-/H+ AntiportersMaria Gabriella Chiariello, Mercedes Alfonso-Prieto, Emiliano Ippoliti, et al.Journal of Chemical Theory and Computation|December 1, 2015
Spectroscopic Properties of Formaldehyde in Aqueous Solution: Insights from Car-Parrinello and TDDFT/CASPT2 CalculationsPaola Lupieri, Emiliano Ippoliti, Piero Altoè, et al.Journal of Chemical Theory and Computation|November 21, 2015
Molecular Recognition of Platinated DNA from Chromosomal HMGB1Trung Hai Nguyen, Giulia Rossetti, Fabio Arnesano, et al.Current Opinion in Structural Biology|April 30, 2024
Multiscale biomolecular simulations in the exascale eraDavid Carrasco-Busturia, Emiliano Ippoliti, Simone Meloni, et al.Plos Computational Biology|September 12, 2014
Molecular simulation-based structural prediction of protein complexes in mass spectrometry: the human insulin dimerJinyu Li, Giulia Rossetti, Jens Dreyer, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|August 12, 2014
Structural biology of cisplatin complexes with cellular targets: the adduct with human copper chaperone atox1 in aqueous solutionVania Calandrini, Trung Hai Nguyen, Fabio Arnesano, et al.Journal of Chemical Theory and Computation|November 24, 2015
Structural Determinants of Cisplatin and Transplatin Binding to the Met-Rich Motif of Ctr1: A Computational Spectroscopy ApproachTrung Hai Nguyen, Fabio Arnesano, Simone Scintilla, et al.Dalton Transactions (Cambridge, England : 2003)|July 2, 2014
Platination of the copper transporter ATP7A involved in anticancer drug resistanceVania Calandrini, Fabio Arnesano, Angela Galliani, et al.Angewandte Chemie (International Ed. in English)|November 25, 2014
Structure and dynamics of oligonucleotides in the gas phaseAnnalisa Arcella, Jens Dreyer, Emiliano Ippoliti, et al.Pageof 4