Synthesis, characterization, molecular docking and molecular dynamics simulations of benzamide derivatives as potential anti-ovarian cancer agents
G. Raja, G. Venkatesh, Jamelah S. Al‐Otaibi, P. Vennila, Y. Sheena Mary, Yudibeth Sixto‐López
Topics & Concepts
ChemistryDensity functional theoryComputational chemistryMoleculeMolecular orbitalMolecular dynamicsSpectroscopyTime-dependent density functional theoryPhysical chemistryCrystallographyOrganic chemistryQuantum mechanicsPhysicsSynthesis and biological activityResearch on Leishmaniasis StudiesEnzyme function and inhibition