Hiroaki Nishizawa

Publication Activity (10 Years)

Years Active: 2016-2019
Publications (10 Years): 3

Top Topics

Boundary Conditions

High Temperature

Top Venues

J. Comput. Chem.

Publications

Ryuhei Harada, Ryunosuke Yoshino, Hiroaki Nishizawa, Yasuteru Shigeta
Temperature-pressure shuffling outlier flooding method enhances the conformational sampling of proteins. J. Comput. Chem. 40 (15) (2019)
Hiroaki Nishizawa, Hisashi Okumura
Rapid QM/MM approach for biomolecular systems under periodic boundary conditions: Combination of the density-functional tight-binding theory and particle mesh Ewald method. J. Comput. Chem. 37 (31) (2016)
Hiroaki Nishizawa, Yoshifumi Nishimura, Masato Kobayashi, Stephan Irle, Hiromi Nakai
Three pillars for achieving quantum mechanical molecular dynamics simulations of huge systems: Divide-and-conquer, density-functional tight-binding, and massively parallel computation. J. Comput. Chem. 37 (21) (2016)