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Fingerprint Dive into the research topics where Hiroshi Watanabe is active. These topic labels come from the works of this person. Together they form a unique fingerprint.

Bacteriorhodopsins Chemical Compounds
Molecular dynamics Chemical Compounds
Molecular mechanics Chemical Compounds
Molecular Dynamics Simulation Medicine & Life Sciences
Water Chemical Compounds
Quantum theory Chemical Compounds
Photosystem II Protein Complex Chemical Compounds
Molecules Chemical Compounds

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Research Output 2007 2019

  • 418 Citations
  • 10 h-Index
  • 19 Article
  • 1 Letter

Quantitative Analysis of QM/MM Boundary Artifacts and Correction in Adaptive QM/MM Simulations

Watanabe, H. & Cui, Q., 2019 Jul 9, In : Journal of chemical theory and computation. 15, 7, p. 3917-3928 12 p.

Research output: Contribution to journalArticle

quantitative analysis
artifacts
discontinuity
Solvation
Computer simulation
3 Citations (Scopus)
Open Access
Molecular Dynamics Simulation
continuity
Molecular dynamics
Computer simulation
Theoretical Models
3 Citations (Scopus)

Cation solvation with quantum chemical effects modeled by a size-consistent multi-partitioning quantum mechanics/molecular mechanics method

Watanabe, H., Kubillus, M., Kubař, T., Stach, R., Mizaikoff, B. & Ishikita, H., 2017 Jan 1, In : Physical Chemistry Chemical Physics. 19, 27, p. 17985-17997 13 p.

Research output: Contribution to journalArticle

Molecular mechanics
chemical effects
Quantum theory
Solvation
solvation
17 Citations (Scopus)

Electron transfer pathways in a multiheme cytochrome MtrF

Watanabe, H., Yamashita, Y. & Ishikita, H., 2017 Mar 14, In : Proceedings of the National Academy of Sciences of the United States of America. 114, 11, p. 2916-2921 6 p.

Research output: Contribution to journalArticle

Open Access
Cytochromes
Heme
Electrons
Molecular Dynamics Simulation
Oxidation-Reduction
13 Citations (Scopus)

Origins of Water Molecules in the Photosystem II Crystal Structure

Sakashita, N., Watanabe, H., Ikeda, T., Saito, K. & Ishikita, H., 2017 Jun 20, In : Biochemistry. 56, 24, p. 3049-3057 9 p.

Research output: Contribution to journalArticle

Open Access
Photosystem II Protein Complex
Crystal structure
Molecules
Water
Molecular Dynamics Simulation