Ligand unbinding mechanisms and kinetics for T4 lysozyme mutants from &#964;RAMD simulations.

Ligand unbinding mechanisms and kinetics for T4 lysozyme mutants from τRAMD simulations.

Nunes-Alves, Ariane; Kokh, Daria B; Wade, Rebecca C.

Afiliação

Nunes-Alves A; Molecular and Cellular Modeling Group, Heidelberg Institute for Theoretical Studies, Schloss-Wolfsbrunnenweg 35, 69118, Heidelberg, Germany.
Kokh DB; Center for Molecular Biology (ZMBH), DKFZ-ZMBH Alliance, Heidelberg University, Im Neuenheimer Feld 282, 69120, Heidelberg, Germany.
Wade RC; Molecular and Cellular Modeling Group, Heidelberg Institute for Theoretical Studies, Schloss-Wolfsbrunnenweg 35, 69118, Heidelberg, Germany.

Curr Res Struct Biol ; 3: 106-111, 2021.

Article em En | MEDLINE | ID: mdl-34235490