Hydration analysis of antiviral agent AZT by means of DFT and MP2 calculations.
Alcolea Palafox
M
M
Departamento de Química-Física I, Facultad de Ciencias Químicas, Universidad Complutense, Ciudad Universitaria, Madrid-28040, Spain. alcolea@quim.ucm.es
Talaya
Jéssica
J
D019380:Anti-HIV Agents / Q000737:chemistry*; D003198:Computer Simulation; D006860:Hydrogen Bonding; D008962:Models, Theoretical; D015394:Molecular Structure; D011789:Quantum Theory; D013816:Thermodynamics; D014867:Water / Q000737:chemistry*; D015215:Zidovudine / Q000737:chemistry*
D019380:Anti-HIV Agents; D014867:Water; D015215:Zidovudine