Channels Analysis of Two New Flavonoid Glycosides From Zanha golungensis Hiern With COX Inhibition Activity: Structural Elucidation, DFT Calculations, In Vitro and Molecular Docking Assessment
Inhibition of Aluminium Corrosion in 1.0 M HCl by Caffeine: Experimental and DFT Studies
Synthesis, Crystal Structure, Hirshfeld Surface, RDG, ELF, LOL, DFT, and Molecular Docking Studies of a Binuclear Copper(II) Carboxylate Complex
Assessment of Antimicrobial Activity, Membrane Integrity, and Oxidative Stress of Green Synthesized Silver Nanoparticles: In Vitro and Molecular Docking Studies
Synthesis of phenylazonaphtol-β---glycosides, evaluation as substrates for beta-glycosidase activity and molecular studies
Synthesis of phenylazonaphtol-β---glycosides, evaluation as substrates for beta-glycosidase activity and molecular studies
Correction to: PyCRDFT: A Python package to evaluate chemical reactivity descriptors within conceptual DFT
In Silico Molecular Docking of Marine Drugs Against Cancer Proteins
In Silico Molecular Docking Analysis of Natural Pyridoacridines as Anticancer Agents
ISOLATION AND STRUCTURAL ELUCIDATION OF BIOACTIVE CONSTITUENTS OF COFFEABREVIPES HIERN AND PSEUDOCERATINAPURPUREA CARTER
Synthesis, antimalarial evaluation, Ç-hematin inhibition, and in silico and in vitro ADMET profiling of 4-aminoquinoline-hydroxypyridinone hybrids
Gene Expression, Docking and Machine Learning in Malaria Drug Discovery: A Systematic Review
The application of nuclear magnetic resonance in the structural elucidation of natural products
A DFT Study of Some Structural and Spectral Properties of 4-Methoxyacetophenone Thiosemicarbazone and Its Complexes with Some Transition Metal Chlorides: Potent Antimicrobial Agents
Identification and Quantification of Aldose Reductase Inhibitory Flavonoids in Herbal Formulation and Extract of Gymnema sylvestre Using HPLC-PDA and LC-MS/MS
A DFT study of the catalytic hydrocyanation of ethylene with nickel complexes
Calculation of field emission parameters from short carbon nanotubes with structural defects
Synthesis and structural elucidation of a novel bis-spirooxindole from isatin and ethylenediamine
Formulation and Evaluation of Propolis Solid Dispersion Loaded Anti-inflammatory Cream with Molecular Docking and In-Vivo Animal Study
Inhibition of mitochondrial RNA polymerase sensitizes cancer cells to radiation by inhibiting mitochondrial respiration
Identification of natural product stereochemistry via calculation of ECD spectra
Structure elucidation of and synthetic approaches to monatin, a metabolite from Schlerochiton ilicifolius
Conformational and docking studies of Gonadotropin releasing hormone and its analogsby NMR spectroscopy and molecular modelling
Evaluation of the Phytochemical Composition, Antioxidant Activity, and Enzyme Inhibitory Potential of Salvia heldreichiana Within the Framework of Molecular Docking and CAVER Tunnel Analysis
Correction: Efficient dye degradation, antimicrobial behavior and molecular docking analysis of gold (Au) and cellulose nanocrystals (CNC)-doped strontium oxide nanocomposites
