Anharmonic vibrational frequency calculations of 5,6-dihydrouracil and its complex with water: testing improved semiempirical potentials for biological molecules

Author： Adesokan Adeyemi A.   Fredj Erick   Brown Eric C.   Gerber R. Benny  

Publisher： Taylor & Francis Ltd

ISSN： 1362-3028

Source： Molecular Physics, Vol.103, Iss.11-12, 2005-06, pp. : 1505-1520

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