Effat Dehghanian

A novel palladium(II) antitumor agent: Synthesis, characterization, DFT perspective, CT-DNA and BSA interaction studies via in-vitro and in-silico approaches

Mehran Feizi‐Dehnayebi, Effat Dehghanian, Hassan Mansouri‐Torshizi · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2020 · 88 citations

Medicinal Chemistry, Medicine, Novel Palladium +8

Enhanced GROMACS: toward a better numerical simulation framework

Hojjat Rakhshani, Effat Dehghanian, Amin Rahati · Journal of Molecular Modeling · 2019 · 83 citations

Numerical Analysis, Numerical Computation, Engineering +7

DNA/BSA binding affinity studies of new Pd(II) complex with S-S and N-N donor mixed ligands via experimental insight and molecular simulation: Preliminary antitumor activity, lipophilicity and DFT perspective

Mehran Feizi‐Dehnayebi, Effat Dehghanian, Hassan Mansouri‐Torshizi · Journal of Molecular Liquids · 2021 · 55 citations

Medicinal Chemistry, Biochemistry, Natural Sciences +11

Synthesis and characterization of Pd(II) antitumor complex, DFT calculation and DNA/BSA binding insight through the combined experimental and theoretical aspects

Mehran Feizi‐Dehnayebi, Effat Dehghanian, Hassan Mansouri‐Torshizi · Journal of Molecular Structure · 2021 · 54 citations

Inorganic Chemistry, Medicinal Chemistry, Biochemistry +12

Probing the biomolecular (DNA/BSA) interaction by new Pd(II) complex via in-depth experimental and computational perspectives: synthesis, characterization, cytotoxicity, and DFT approach

Mehran Feizi‐Dehnayebi, Effat Dehghanian, Hassan Mansouri‐Torshizi · Journal of the Iranian Chemical Society · 2022 · 45 citations · Full text

Engineering, Biochemistry, Natural Sciences +9