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Vibrational analysis, DFT computations of spectroscopic, non-covalent analysis with molecular docking and dynamic simulation of 2-amino-4, 6-dimethyl pyrimidine benzoic acid

P. Divya, V.S. Jeba Reeda, S. Renuga, C. Devi Annapoorani, V. Bena Jothy

2024Journal of Molecular Structure20 citationsDOI

Topics & Concepts

ChemistryPyrimidineDocking (animal)Benzoic acidComputational chemistryCovalent bondMolecular dynamicsStereochemistryOrganic chemistryNursingMedicineNonlinear Optical Materials ResearchSpectroscopy and Quantum Chemical StudiesPhotochemistry and Electron Transfer Studies
Vibrational analysis, DFT computations of spectroscopic, non-covalent analysis with molecular docking and dynamic simulation of 2-amino-4, 6-dimethyl pyrimidine benzoic acid | Litcius