Multicanonical algorithm combined with the RISM theory for simulating peptides in aqueous solutionAyori Mitsutake; Masahiro Kinoshita; Yuko Okamoto; Fumio Hirata · 2000

Singular behavior of the reference interaction site model theory observed for peptide in salt solutionMasahiro Kinoshita; Yuko Okamoto; Fumio Hirata · 1998

Peptide Conformations in Alcohol and Water:  Analyses by the Reference Interaction Site Model TheoryKinoshita, Masahiro; Okamoto, Yuko; Hirata, Fumio · Journal of the American Chemical Society · 2000

Calculation of solvation free energy using RISM theory for peptide in salt solutionKinoshita, Masahiro; Okamoto, Yuko; Hirata, Fumio · Journal of Computational Chemistry · 1998

Solvation structure and stability of peptides in aqueous solutions analyzed by the reference interaction site model theoryKinoshita, Masahiro; Okamoto, Yuko; Hirata, Fumio · The Journal of Chemical Physics · 1997

First-Principle Determination of Peptide Conformations in Solvents:  Combination of Monte Carlo Simulated Annealing and RISM TheoryKinoshita, Masahiro; Okamoto, Yuko; Hirata, Fumio · Journal of the American Chemical Society · 1998

Calculation of hydration free energy for a solute with many atomic sites using the RISM theory: A robust and efficient algorithmKinoshita, Masahiro; Okamoto, Yuko; Hirata, Fumio · Journal of Computational Chemistry · 1997