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Fast Monte Carlo simulation of DNA damage formed by electrons and light ions

V A Semenenko and R D Stewart

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The passage of ionizing radiation through living organisms initiates physical and chemical processes that create clusters of damaged nucleotides within one or two turns of the DNA. These clusters are widely considered an important initiating event for the induction of other biological endpoints, including cell killing and neoplastic transformation. Monte Carlo simulations of the DNA damage formation process are a useful adjunct to experiments because they provide additional information about the spatial configuration of damage within a cluster. In this paper, the fast Monte Carlo damage simulation (MCDS) algorithm is re-parameterized so that yields of double-strand breaks, single-strand breaks and sites of multiple base damage can be simulated for electrons, protons and α particles with kinetic energies on the order of GeV. The MCDS algorithm provides a useful, quasi-phenomenological scheme to interpolate damage yields from computationally expensive, but more detailed, track-structure simulations. The predicted characteristics of various classes of damage produced by electrons, protons and α particles, such as average number of lesions per DNA damage cluster and cluster length in base pairs, are presented. A study examining the effects on damage complexity of an extrinsic free radical scavenger, dimethyl sulfoxide, is also presented. The reported studies provide new information that will aid efforts to characterize the relative biological effectiveness of high-energy protons and other light ions, which are sometimes used in particle therapy for the treatment of cancer.


PACS

87.15.M- Spectra of biomolecules

02.50.Ng Distribution theory and Monte Carlo studies

87.14.G- Nucleic acids

87.53.-j Effects of ionizing radiation on biological systems

87.50.W- Optical/infrared radiation effects

87.15.A- Theory, modeling, and computer simulation

Subjects

Computational physics

Medical physics

Biological physics

Dates

Issue 7 (7 April 2006)

Received 1 November 2005, in final form 31 January 2006

Published 7 March 2006



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