BiophysicsPLoS Computational BiologyPeer-reviewed
Mechanistic insights into ligand dissociation from the SARS-CoV-2 spike glycoprotein
Timothy Hasse, Esra Mantei, Rezvan Shahoei…·Yu‐ming M. Huang
This study investigates ligand dissociation from the SARS-CoV-2 spike glycoprotein using simulations, revealing two unbinding pathways and key residues involved in ligand binding and ACE2 interaction.
3 citations