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Folding Dynamics of 3,4,3-LI(1,2-HOPO) in Its Free and Bound State with U(4+) Implicated by MD Simulations
The octadentate hydroxypyridonate ligand 3,4,3-LI(1,2-HOPO) (t-HOPO) shows strong binding affinity with actinide cations and is considered as a promising decorporation agent used to eliminate in vivo actinides, while its dynamics in its unbound and bound states in the condensed phase remain unclear....
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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MDPI
2022
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9740235/ https://www.ncbi.nlm.nih.gov/pubmed/36500244 http://dx.doi.org/10.3390/molecules27238151 |