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Physical Chemistry Chemical Physics : PCCP|May 17, 2024
Unraveling the interaction between singlet state atomic oxygen O(<sup>1</sup>D) and water: toward the formation of oxywater and hydrogen peroxideJos Suijker, Behnaz BagheriPhysical Chemistry Chemical Physics : PCCP|July 26, 2016
Getting excited: challenges in quantum-classical studies of excitons in polymeric systemsBehnaz Bagheri, Björn Baumeier, Mikko KarttunenPhysical Chemistry Chemical Physics : PCCP|July 4, 2023
Effect of oxidation on POPC lipid bilayers: anionic carboxyl group plays a major roleBehnaz Bagheri, Phansiri Boonnoy, Jirasak Wong-Ekkabut, et al.Journal of Chemical Theory and Computation|December 29, 2025
Coupling Solvation Thermodynamics and Chemical Speciation: A Simulation-Based Approach to NO<sub><i>x</i></sub> Uptake in Aqueous EnvironmentsTijin H G Saji, Thijs J H Vlugt, Sofia Calero, et al.Physical Chemistry Chemical Physics : PCCP|June 16, 2025
Modeling nitric oxide and its dimer: force field development and thermodynamics of dimerizationTijin H G Saji, Thijs J H Vlugt, Sofia Calero, et al.The Journal of Physical Chemistry. B|April 24, 2026
Predicting Absorption and Diffusion of Plasma-Generated O(<sup>3</sup>P), O(<sup>1</sup>D), and Other RONS in Aqueous Environments Using Molecular SimulationsTijin H G Saji, Thijs J H Vlugt, Sofia Calero, et al.RSC Advances|September 16, 2024
Cholesterol inhibits oxygen permeation through biological membranes: mechanism against double-bond peroxidationPhansiri Boonnoy, Minchakarn Janlad, Behnaz Bagheri, et al.ACS Applied Materials & Interfaces|January 30, 2026
Decoupling Electric Field and Temperature-Driven Atomistic Forming Mechanisms in TaO<sub><i>x</i></sub>/HfO<sub>2</sub>-Based ReRAMs Using Reactive Molecular Dynamics SimulationsSimanta Lahkar, Valeria Bragaglia, Behnaz Bagheri, et al.The Kaohsiung Journal of Medical Sciences|January 2, 2026
Exome Sequencing Identifies Variants in MLH1 and ERBB2 as Potential Cancer-Predisposing Factors in Familial Early-Onset Colorectal CancerBehnaz Bagheri, Neda Mohsen-Pour, Najmeh Salehi, et al.Journal of the American Chemical Society|March 5, 2025
Structure and pH Dependence of Membranolytic Mechanisms by Truncated Oxidized PhospholipidsMin Xie, Maik G N Derks, Eveline H W Koch, et al.Pageof 1