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Experimental and theoretical investigation of the mechanism of radiation-induced radical formation in hydrogen-bonded cocrystals of 1-methylcytosine and 5-fluorouracil
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Physics, Department of Quantum Chemistry.
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2000 (English)In: JOURNAL OF PHYSICAL CHEMISTRY B, ISSN 1089-5647, Vol. 104, no 39, 9343-9350 p.Article in journal (Refereed) Published
Abstract [en]

The process of stabilizing radiation damage in the base pair of 1-methylcytosine (1-MeC):5-fluorouracil (5-FU) has been investigated. The formation of free radicals in purines and pyrimidines is influenced by the matrix in which they are irradiated. Of pa

Place, publisher, year, edition, pages
AMER CHEMICAL SOC , 2000. Vol. 104, no 39, 9343-9350 p.
Keyword [en]
POLARIZABLE CONTINUUM MODEL; IRRADIATED SINGLE-CRYSTALS; MOLECULAR-ORBITAL METHODS; GAUSSIAN-BASIS SETS; SOLID-STATE; IONIZING-RADIATION; AB-INITIO; DENSITY; GEOMETRY; ENDOR
Identifiers
URN: urn:nbn:se:uu:diva-36843OAI: oai:DiVA.org:uu-36843DiVA: diva2:64742
Note
Addresses: Close DM, E Tennessee State Univ, Dept Phys, POB 70652, Johnson City, TN 37614 USA. E Tennessee State Univ, Dept Phys, Johnson City, TN 37614 USA. Uppsala Univ, Dept Quantum Chem, S-75120 Uppsala, Sweden. Univ Oslo, Dept Phys, N-0316 Oslo, NorwAvailable from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-14

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