Theoretical Study of the Effects of Different Coordination Atoms (O/S/N) on Crystal Structure, Stability, and Protein/DNA Binding of Ni(II) Complexes with Pyridoxal-Semi, Thiosemi, and Isothiosemicarbazone Ligand Systems

Nickel transition metal complexes have shown various biological activities that depend on the ligands and geometry. In this contribution, six Ni(II) nitrate complexes with pyridoxal-semi, thiosemi, and isothiosemicarbazone ligands were examined using theoretical chemistry methods. The structures of...

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Autors principals:	Violeta Jevtovic, Aleksandra Rakić, Odeh A. O. Alshammari, Munirah Sulaiman Alhar, Tahani Alenezi, Violeta Rakic, Dušan Dimić
Format:	Artigo
Idioma:	Inglês
Publicat:	MDPI AG 2024-09-01
Col·lecció:	Inorganics
Matèries:	nickel(II) complexes DFT QTAIM HSA DNA molecular docking
Accés en línia:	https://www.mdpi.com/2304-6740/12/9/251
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