A free-energy perturbation method based on Monte Carlo simulations using quantum mechanical calculations (QM/MC/FEP method): Application to highly solvent-dependent reactions. - Kenji Hori; Toru Yamaguchi; Keita Uezu; Michinori Sumimoto (J. Comput. Chem., 2011)

Theoretical study on the molecular structures of X-, α-, and β-types of lithium phthalocyanine dimer. - Michinori Sumimoto; Yukio Kawashima; Daisuke Yokogawa; Kenji Hori; Hitoshi Fujimoto (J. Comput. Chem., 2011)