Practical Protocols for Efficient Sampling of Kinase-Inhibitor Binding Pathways Using Two-Dimensional Replica-Exchange Molecular Dynamics

por Shinobu, Ai, Re, Suyong, Sugita, Yuji
Publicado 2022

Building a macro-mixing dual-basin Gō model using the Multistate Bennett Acceptance Ratio

por Shinobu, Ai, Kobayashi, Chigusa, Matsunaga, Yasuhiro, Sugita, Yuji
Publicado 2019

Essential ion binding residues for Na(+) flow in stator complex of the Vibrio flagellar motor

por Onoue, Yasuhiro, Iwaki, Masayo, Shinobu, Ai, Nishihara, Yasutaka, Iwatsuki, Hiroto, Terashima, Hiroyuki, Kitao, Akio, Kandori, Hideki, Homma, Michio
Publicado 2019