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Takao Otsuka
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2020 – today
- 2025
- [j6]Romeo Cozac, Haris Hasic
, Jun Jin Choong, Vincent Richard, Loic Beheshti, Cyrille Froehlich, Takuto Koyama, Shigeyuki Matsumoto, Ryosuke Kojima, Hiroaki Iwata, Aki Hasegawa, Takao Otsuka, Yasushi Okuno:
kMoL: an open-source machine and federated learning library for drug discovery. J. Cheminformatics 17(1): 22 (2025)
2010 – 2019
- 2018
- [c1]Naohisa Hashimoto, Simon Thompson, Yusuke Takinami, Kazuhisa Mizushima, Takao Otsuka, Manabu Omae, Shin Kato
Introduction of Prototype of Remote Type Automated Vehicle System by using Communication between Operator and Vehicles in Real Environment. ITST 2018: 1-2 - 2015
- [j5]Takao Otsuka, Noriaki Okimoto, Makoto Taiji:
Assessment and acceleration of binding energy calculations for protein-ligand complexes by the fragment molecular orbital method. J. Comput. Chem. 36(30): 2209-2218 (2015)
2000 – 2009
- 2007
- [j4]Takao Otsuka, Hiromi Nakai
Wavelet transform analysis of ab initio molecular dynamics simulation: Application to core-excitation dynamics of BF3. J. Comput. Chem. 28(6): 1137-1144 (2007) - [j3]Yutaka Imamura, Takao Otsuka, Hiromi Nakai
Description of core excitations by time-dependent density functional theory with local density approximation, generalized gradient approximation, meta-generalized gradient approximation, and hybrid functionals. J. Comput. Chem. 28(12): 2067-2074 (2007) - 2002
- [j2]Takao Otsuka, Seiji Koizumi, Kazunaka Endo, Hiroyuki Kawabe, Delano P. Chong:
Theoretical auger electron spectra of polymers by density functional theory calculations using model dimers. J. Comput. Chem. 23(3): 394-401 (2002) - 2001
- [j1]Kazunaka Endo, Seiji Koizumi, Takao Otsuka, M. Suhara, T. Morohasi, E. Z. Kurmaev, Delano P. Chong:
Analysis of XPS and XES of diamond and graphite by DFT calculations using model molecules. J. Comput. Chem. 22(1): 102-108 (2001)
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