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Dissociation of minor groove binders from DNA: insights from metadynamics simulations
We have used metadynamics to investigate the mechanism of noncovalent dissociation from DNA by two representatives of alkylating and noncovalent minor groove (MG) binders. The compounds are anthramycin in its anhydrous form (IMI) and distamycin A (DST), which differ in mode of binding, size, flexibi...
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| Autori principali: | , , , |
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| Natura: | Artigo |
| Lingua: | Inglês |
| Pubblicazione: |
Oxford University Press
2008
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| Soggetti: | |
| Accesso online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2566863/ https://ncbi.nlm.nih.gov/pubmed/18801848 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/nar/gkn561 |
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