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Molecular Dynamics Simulations of Supramolecular Anticancer Nanotubes

We report here on long-time all-atomistic molecular dynamics simulations of functional supramolecular nanotubes composed by the self-assembly of peptide-drug amphiphiles (DAs). These DAs have been shown to possess an inherently high drug loading of the hydrophobic anticancer drug camptothecin. We pr...

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Foilsithe in:J Chem Inf Model
Main Authors: Kang, Myungshim, Chakraborty, Kaushik, Loverde, Sharon M.
Formáid: Artigo
Teanga:Inglês
Foilsithe: 2018
Ábhair:
Rochtain Ar Líne:https://ncbi.nlm.nih.gov/pmc/articles/PMC6261261/
https://ncbi.nlm.nih.gov/pubmed/29856610
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.8b00193
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