Y. Tanida

发表

Direct calculation of the binding free energies of FKBP ligands.

Michael R. Shirts, Eric J. Sorin, M. Shirts, 2005, The Journal of chemical physics.

Massively parallel computation of absolute binding free energy with well-equilibrated states.

H. Fujitani, Y. Tanida, A. Matsuura, 2009, Physical review. E, Statistical, nonlinear, and soft matter physics.

Docking study and binding free energy calculation of poly (ADP-ribose) polymerase inhibitors

K. Ohno, M. Orita, H. Fujitani, 2011, Journal of molecular modeling.

ELECTRONIC PROPERTIES OF (GaP)m/(AiP)n SUPERLATTICES

Y. Tanida, M. Ikeda, 1994 .

Prediction of the Multiple Binding Poses in Classical System Using Metadynamics

Y. Tanida, A. Matsuura, 2016 .

Electronic properties of metal-induced gap states at insulator/metal interfaces: Dependence on the alkali halide and the possibility of excitonic mechanism of superconductivity

R. Arita, H. Aoki, K. Kuroki, 2003, cond-mat/0308155.

Monte Carlo Study of Dipole Glass Freezing

Tetsuya Yamamoto, Y. Tanida, H. Ishii, 1988 .

Binding and diffusion of an al adatom on the hydrogen-terminated si(100) surface

Y. Tanida, Ikeda Minoru, 1996 .

Alchemical free energy calculations via metadynamics: Application to the theophylline‐RNA aptamer complex

Azuma Matsuura, Yoshiaki Tanida, Y. Tanida, 2020, J. Comput. Chem..

High-Level ab Initio Calculations To Improve Protein Backbone Dihedral Parameters.

Hideaki Fujitani, Azuma Matsuura, Sino Sakai, 2009, Journal of chemical theory and computation.

Metal-induced gap states at well defined alkali-halide/metal interfaces.

R. Arita, H. Aoki, G. Yoshikawa, 2003, Physical review letters.

Metal-induced gap states in epitaxial organic-insulator/metal interfaces

R. Arita, T. Ohta, H. Aoki, 2004, cond-mat/0408677.

Polar surface engineering in ultrathin MgO(111)∕Ag(111) : Possibility of a metal-insulator transition and magnetism

R. Arita, H. Aoki, Y. Tanida, 2004, cond-mat/0401051.