NBO analysis of the torquoselectivity of the electrocyclic reactions of mono-substituted cyclobutenes. - Amar Saal; Lynda Merzoud (J. Comput. Methods Sci. Eng., 2016)

Understanding the intermolecular Diels-Alder cycloaddition promotion: Activation strain model/energy decomposition analysis model and conceptual density functional theory viewpoints. - Lynda Merzoud; Frédéric Guégan; Henry Chermette; Christophe Morell (J. Comput. Chem., 2021)

A computational investigation of the selectivity and mechanism of the Lewis acid catalyzed oxa-Diels-Alder cycloaddition of substituted diene with benzaldehyde. - Abdelmalek Khorief Nacereddine; Lynda Merzoud; Christophe Morell; Henry Chermette (J. Comput. Chem., 2021)

Understanding the mechanism and regio- and stereo selectivity of [3 + 2] cycloaddition reactions between substituted azomethine ylide and 3, 3, 3-trifluoro-1-nitroprop-1-ene, within the molecular electron density theory. - Chafia Sobhi; Lynda Merzoud; Souad Bouasla; Abdelmalek Khorief Nacereddine; Christophe Morell; Henry Chermette (J. Comput. Chem., 2023)