Ligand shape emerges in solvent dipole ordering region at ligand binding site of protein. - Katsumi Murata; Naoya Nagata; Isao Nakanishi; Kazuo Kitaura (J. Comput. Chem., 2010)

SDOVS: A solvent dipole ordering-based method for virtual screening. - Katsumi Murata; Naoya Nagata; Isao Nakanishi; Kazuo Kitaura (J. Comput. Chem., 2010)

Subtle Structural Changes in Tetrahydroquinolines, A New Class of Nonsteroidal Selective Androgen Receptor Modulators, Induce Different Functions. - Naoya Nagata; Kentaro Kawai; Isao Nakanishi (J. Chem. Inf. Model., 2012)

De Novo Design of Drug-Like Molecules by a Fragment-Based Molecular Evolutionary Approach. - Kentaro Kawai; Naoya Nagata; Yoshimasa Takahashi (J. Chem. Inf. Model., 2014)