Comparative ligand structural analytics illustrated on variably glycosylated MUC1 antigen–antibody binding

When faced with the investigation of the preferential binding of a series of ligands against a known target, the solution is not always evident from single structure analysis. An ensemble of structures generated from computer simulations is valuable; however, visual analysis of the extensive structu...

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Bibliographic Details
Main Authors: Christopher B. Barnett, Tharindu Senapathi, Kevin J. Naidoo
Format: Article
Language:English
Published: Beilstein-Institut 2020-10-01
Series:Beilstein Journal of Organic Chemistry
Subjects:
Online Access:https://doi.org/10.3762/bjoc.16.206