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Takuya Fujie
ORCID
Publication Activity (10 Years)
Years Active: 2021-2023
Publications (10 Years): 3
Top Topics
Fine Grained
Database
Molecular Dynamics Simulations
Binding Peptides
Top Venues
J. Chem. Inf. Model.
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Publications
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Jianan Li
,
Keisuke Yanagisawa
,
Masatake Sugita
,
Takuya Fujie
,
Masahito Ohue
,
Yutaka Akiyama
CycPeptMPDB: A Comprehensive Database of Membrane Permeability of Cyclic Peptides.
J. Chem. Inf. Model.
63 (7) (2023)
Masatake Sugita
,
Takuya Fujie
,
Keisuke Yanagisawa
,
Masahito Ohue
,
Yutaka Akiyama
Lipid Composition Is Critical for Accurate Membrane Permeability Prediction of Cyclic Peptides by Molecular Dynamics Simulations.
J. Chem. Inf. Model.
62 (18) (2022)
Masatake Sugita
,
Satoshi Sugiyama
,
Takuya Fujie
,
Yasushi Yoshikawa
,
Keisuke Yanagisawa
,
Masahito Ohue
,
Yutaka Akiyama
Large-Scale Membrane Permeability Prediction of Cyclic Peptides Crossing a Lipid Bilayer Based on Enhanced Sampling Molecular Dynamics Simulations.
J. Chem. Inf. Model.
61 (7) (2021)