Density functional theory investigation of hyperfine interaction in DNA nucleobase and nucleotide muoniated radicals
Density Functional Theory method at B3LYP=6-311++G(d,p) level of theory was successfully applied to investigate the structure, energy, and associated muonium hyperfine coupling constant of radicals produced by muonium addition to DNA nitrogenous bases (guanine, adenine, cytosine, and thymine) in nuc...
| Published in: | Journal of the Physical Society of Japan |
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| Main Author: | |
| Format: | Article |
| Language: | English |
| Published: |
Physical Society of Japan
2021
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| Online Access: | https://www.scopus.com/inward/record.uri?eid=2-s2.0-85103567528&doi=10.7566%2fJPSJ.90.044301&partnerID=40&md5=73d72273cf37e7895cb4a1bf9d101f3f |