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Majumdar, D and Philip, JE and Dubey, A and Tufail, A and Roy, S (2023) Synthesis, spectroscopic findings, SEM/EDX, DFT, and single-crystal structure of Hg/Pb/Cu–SCN complexes: In silico ADME/T profiling and promising antibacterial activities. In: Heliyon, 9 (5).
Majumdar, D and Philip, JE and Tüzün, B and Roy, S (2023) Synthesis, characterization, crystallographic aspects, Fukui function, and photodynamic antifungal chemotherapy investigation of Cd(II)-tricyanomethanide coordination polymer: Insights from DFT. In: Inorganic Chemistry Communications, 155 .
Majumdar, D and Philip, JE and Tüzün, B and Frontera, A and Gomila, RM and Roy, S and Bankura, K (2022) Unravelling the Synthetic Mimic, Spectroscopic Insights, and Supramolecular Crystal Engineering of an Innovative Heteronuclear Pb(II)-Salen Cocrystal: An Integrated DFT, QTAIM/NCI Plot, NLO, Molecular Docking/PLIP, and Antibacterial Appraisal. In: Journal of Inorganic and Organometallic Polymers and Materials .