Kento Kasahara

New parallel computing algorithm of molecular dynamics for extremely huge scale biological systems

Jaewoon Jung, Chigusa Kobayashi, Kento Kasahara et al. · Journal of Computational Chemistry · 2020 · 79 citations · Full text

Natural Sciences, Biophysics, High-performance Computing +14

Encounter complexes and hidden poses of kinase-inhibitor binding on the free-energy landscape

Suyong Re, Hiraku Oshima, Kento Kasahara et al. · Proceedings of the National Academy of Sciences · 2019 · 63 citations · Full text

Pharmacy, Biophysics, Medicinal Chemistry +17

Optimized Hydrogen Mass Repartitioning Scheme Combined with Accurate Temperature/Pressure Evaluations for Thermodynamic and Kinetic Properties of Biological Systems

Jaewoon Jung, Kento Kasahara, Chigusa Kobayashi et al. · Journal of Chemical Theory and Computation · 2021 · 47 citations · Full text

Natural Sciences, Biochemistry, Biophysics +17

Reduced efficacy of a Src kinase inhibitor in crowded protein solution

Kento Kasahara, Suyong Re, Grzegorz Nawrocki et al. · Nature Communications · 2021 · 35 citations · Full text

Life Sciences, Biochemistry, Molecular Biology +17

Crystal Growth of Urea and Its Modulation by Additives as Analyzed by All-Atom MD Simulation and Solution Theory

Senri Tanaka, Naoki Yamamoto, Kento Kasahara et al. · The Journal of Physical Chemistry B · 2022 · 13 citations

Natural Sciences, Chemistry, Materials Science +17