Docking Survey, ADME, Toxicological Insights, and Mechanistic Exploration of the Diels-Alder Reaction Between Hexachlorocyclopentadiene and Dichloroethylene

von Kącka-Zych, Agnieszka
Veröffentlicht in: Journal of computational chemistry (2025)

Mechanistic aspects of the synthesis of seven-membered internal nitronates via stepwise [4 + 3] cycloaddition involving conjugated nitroalkenes Molecular Electron Density Theory co...

von Kącka-Zych, Agnieszka
Veröffentlicht in: Journal of computational chemistry (2022)

Understanding the molecular mechanism of γ-elimination of nitrous acid in the framework of the molecular electron density theory

von Kącka-Zych, Agnieszka
Veröffentlicht in: Journal of computational chemistry (2021)