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List of works by Hideaki Takahashi

A simple and effective solution to the constrained QM/MM simulations

scientific article published on 01 April 2018

Calculation of solvation free energy utilizing a constrained QM/MM approach combined with a theory of solutions

scientific article published on 01 March 2019

Drastic Compensation of Electronic and Solvation Effects on ATP Hydrolysis Revealed through Large-Scale QM/MM Simulations Combined with a Theory of Solutions.

scientific article published on 21 February 2017

Large-Scale Parallel Implementation of Hartree-Fock Exchange Energy on Real-Space Grids Using 3D-Parallel Fast Fourier Transform

scientific article published on 04 March 2020

Role of the Photosystem II as an Environment in the Oxidation Free Energy of the Mn Cluster from S1 to S2

scientific article published on 19 July 2019

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