Theoretical Study of Stability and Electronic Characteristics in Various Complexes of Psoralen as an Anticancer Drug in Gas Phase, Water and CCl4 Solutions
Marziyeh Mohammadi, Maryam Mahinian, Azadeh Khanmohammadi
Topics & Concepts
Natural bond orbitalChemistryDensity functional theoryMoleculeReactivity (psychology)Computational chemistrySolventChemical polarityPhase (matter)Charge densityPsoralenAtoms in moleculesChemical bondMetalPhysical chemistryChemical physicsOrganic chemistryDNAPhysicsPathologyAlternative medicineBiochemistryMedicineQuantum mechanicsBioactive Compounds and Antitumor AgentsNonlinear Optical Materials ResearchFree Radicals and Antioxidants