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Effects of ionization on stability of 1-methylcytosine — DFT and PCM studies
Consequences of ionization were studied by quantum-chemical methods (DFT and PCM) for 1-methylcytosine (MC)—a model of the nucleobase cytosine (C) connected with sugar in DNA. For calculations, three prototropic tautomers (one amino and two imino forms) and two imino zwitterions were considered, inc...
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| Udgivet i: | J Mol Model |
|---|---|
| Main Authors: | , , , |
| Format: | Artigo |
| Sprog: | Inglês |
| Udgivet: |
Springer Berlin Heidelberg
2016
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| Fag: | |
| Online adgang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4893064/ https://ncbi.nlm.nih.gov/pubmed/27259531 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s00894-016-3020-2 |
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