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Quantum chemical calculations predict biological function: the case of T cell receptor interaction with a peptide/MHC class I
A combination of atomic correlation statistics and quantum chemical calculations are shown to predict biological function. In the present study, various antigenic peptide-Major Histocompatibility Complex (pMHC) ligands with near-identical stereochemistries, in complexation with the same T cell recep...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Frontiers Media S.A.
2015
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4322848/ https://www.ncbi.nlm.nih.gov/pubmed/25713797 http://dx.doi.org/10.3389/fchem.2015.00009 |