Computational structure prediction for antibody-antigen complexes from hydrogen-deuterium exchange mass spectrometry: Challenges and outlook. Front. Immunol., (13):859964, Frontiers Media SA, May 2022. [PUMA: mass modeling epitope-paratope hydrogen-deuterium protein-protein docking; (HDX-MS); interaction; identification; biology; integrative structure antibody-antigen structural topic_lifescience spectrometry exchange]
Modeling of protein conformational changes with Rosetta guided by limited experimental data. Structure, (30)8:1157--1168.e3, Elsevier BV, August 2022. [PUMA: molecular EPR dynamics; biology; integrative structure modeling; structural protein changes; topic_lifescience refinement conformational spectroscopy; Rosetta;]