Maria Bzówka

The paper uses simulations to show that V2Rpp binding broadens the conformational landscape of arrestin-2 beyond C-tail detachment, with interdomain rotation angles being less favored without V2Rpp.

This study uses simulations to show that buprenorphine restricts the conformational states of the μ-opioid receptor compared to endomorphin-1, affecting signaling bias and efficacy.

The paper studies tunnel evolution in soluble epoxide hydrolases, finding conserved tunnel-lining residues and variable residues that respond to evolutionary pressure, proposing methods for tunnel design and enzyme reengineering.

The paper analyzes the structural and evolutionary features of SARS-CoV-2 Mpro, finding that its active site differences and flexibility make it a poor target for small-molecule inhibitors.