Allosteric response to ligand binding: Molecular dynamics study of the N-terminal domains in IP3 receptor

by Kei Moritsugu, Tsubasa Ito, Akinori Kidera
Published 2019-11-01

Exploring Configuration Space and Path Space of Biomolecules Using Enhanced Sampling Techniques—Searching for Mechanism and Kinetics of Biomolecular Functions

by Hiroshi Fujisaki, Kei Moritsugu, Yasuhiro Matsunaga
Published 2018-10-01

Energy landscape of all-atom protein-protein interactions revealed by multiscale enhanced sampling.

by Kei Moritsugu, Tohru Terada, Akinori Kidera
Published 2014-10-01

Dynamic recognition and linkage specificity in K63 di-ubiquitin and TAB2 NZF domain complex

by Kei Moritsugu, Hafumi Nishi, Keiichi Inariyama, Masanori Kobayashi, Akinori Kidera
Published 2018-11-01

Motion Tree Delineates Hierarchical Structure of Protein Dynamics Observed in Molecular Dynamics Simulation.

by Kei Moritsugu, Ryotaro Koike, Kouki Yamada, Hiroaki Kato, Akinori Kidera
Published 2015-01-01

Minimum free energy path of ligand-induced transition in adenylate kinase.

by Yasuhiro Matsunaga, Hiroshi Fujisaki, Tohru Terada, Tadaomi Furuta, Kei Moritsugu, Akinori Kidera
Published 2012-01-01

Energetics and conformational pathways of functional rotation in the multidrug transporter AcrB

by Yasuhiro Matsunaga, Tsutomu Yamane, Tohru Terada, Kei Moritsugu, Hiroshi Fujisaki, Satoshi Murakami, Mitsunori Ikeguchi, Akinori Kidera
Published 2018-03-01