Browsing by Author "Antipas G.S.E., Germenis A.E."
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Atomic coordination reflects peptide immunogenicity
Antipas G.S.E., Germenis A.E. (2016)We demonstrated that the immunological identity of variant peptides may be accurately predicted on the basis of atomic coordination of both unprotonated and protonated tertiary structures, provided that the structure of ... -
The coordination of unprotonated peptide tertiary structure as a metric of pMHC-TCR functional avidity
Antipas G.S.E., Germenis A.E. (2015)The coordination difference between the unprotonated tertiary structures of a native (Tax) peptide and a number of its variants - all peptides presented by HLA-A201 and bound to the human A6 T cell receptor-was discovered ... -
Quantum chemical calculations predict biological function: The case of T cell receptor interaction with a peptide/MHC class I
Antipas G.S.E., Germenis A.E. (2015)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 ...