Investigation of antituberculosis, antimicrobial, anti-inflammatory efficacies of newly synthesized transition metal(II) complexes of hydrazone ligands: structural elucidation and theoretical studies

Binesh Kumar, Jai Devi, Amit Dubey, +2

Scientific Reports

Exploring the antimalarial, antioxidant, anti-inflammatory activities of newly synthesized transition metal(II) complexes bearing thiosemicarbazone ligands: Insights from molecular docking, DFT, MESP and ADMET studies

Binesh Kumar, Jai Devi, Amit Dubey, +2

Inorganic Chemistry Communications

BiochemistryThiosemicarbazone LigandsMedicineCoordination ComplexPharmacology +5

Synthesis, spectroscopic investigation, molecular docking, ADME/T toxicity predictions, and DFT study of two trendy ortho vanillin-based scaffolds

Dhrubajyoti Majumdar, Amit Dubey, Aisha Tufail, +2

Heliyon

RETRACTED: 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

Dhrubajyoti Majumdar, Jessica Elizabeth Philip, Amit Dubey, +2

Heliyon

Instigating the in vitro antidiabetic activity of new tridentate Schiff base ligand appended M(II) complexes: From synthesis, structural characterization, quantum computational calculations to molecular docking, and molecular dynamics simulation studies

Yogesh Deswal, Sonika Asija, Aisha Tufail, +6

Applied Organometallic Chemistry

Structural CharacterizationO PhenolicChemistryPharmaceutical ChemistryInorganic Compound +15

Spectroscopic studies, antimicrobial activity, and computational investigations of hydrazone ligands endowed metal chelates

Tanisha Arora, Jai Devi, Amit Dubey, +2

Applied Organometallic Chemistry

Hydrazone LigandsInorganic ChemistryChemical EngineeringFungal PathogensMetal Chelates +12

Organyltellurium(IV) complexes incorporating Schiff base ligand derived from 2-hydroxy-1-naphthaldehyde: Preparation, spectroscopic investigations, antimicrobial, antioxidant activities, DFT, MESP, NBO, molecular docking and ADMET evaluation

Mahak Dalal, Amit Dubey, Aisha Tufail, +3

Journal of Molecular Structure

Inorganic CompoundInorganic ChemistryMedicinal ChemistryEngineeringBiochemistry +9

Inspecting the anti‐tuberculosis, antimicrobial, and anti‐inflammatory efficiency of newly synthesized Co (II), Ni (II), Cu (II) and Zn (II) complexes of hydrazone ligands: Characterization and computational studies

Binesh Kumar, Jai Devi, Amit Dubey, +2

Applied Organometallic Chemistry

Hydrazone LigandsEngineeringChemistryInorganic CompoundMedicinal Chemistry +15

Biological and Computational Investigation of Transition metal(II) Complexes of 2-phenoxyaniline-based Ligands

Binesh Kumar, Jai Devi, Amit Dubey, +2

Future Medicinal Chemistry

Metal Complexes of 1,2,4-Triazole Based Ligand: Synthesis, Structural Elucidation, DFT Calculations, Alpha-Amylase and Alpha-Glucosidase Inhibitory Activity Along with Molecular Docking Studies

Yogesh Deswal, Sonika Asija, Aisha Tufail, +6

Journal of Inorganic and Organometallic Polymers and Materials

Inorganic ChemistryMedicinal ChemistryMolecular Docking StudiesBiochemistryNatural Sciences +8