A supramolecular cavitand for selective chromatographic separation of peptides using LC-MS/MS: a combined in silico and experimental approach

• Published in: New journal of chemistry Vol. 45; no. 1; pp. 141 - 146
• Main Authors: Mekapothula, Subbareddy, Wonanke, A. D. Dinga, Addicoat, Matthew A., Wallis, John D., Boocock, David J., Cave, Gareth W. V.
• Format: Journal Article
• Language: English
• Published: Cambridge Royal Society of Chemistry 07.01.2021
• Subjects: Chromatography; Column chromatography; High performance liquid chromatography; Mass spectrometry; Morphology; Peptides; Selectivity; Separation; Silicon dioxide

The effective separation of a mixed peptide sample has been achieved via a computational strategy towards the bespoke design of a new silica bound supramolecular host capable of selectively interacting with different peptides via their morphology and amino acid functionalities. The experimental and...