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Yuji Mochizuki
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Journal Articles
- 2024
- [j10]Sota Matsuoka, Kota Sakakura, Yoshinobu Akinaga
, Kazuki Akisawa, Koji Okuwaki
, Hideo Doi
, Yuji Mochizuki
:
Enhancement of energy decomposition analysis in fragment molecular orbital calculations. J. Comput. Chem. 45(12): 898-902 (2024) - 2020
- [j9]Yoshinobu Akinaga
, Koichiro Kato
, Tatsuya Nakano
, Kaori Fukuzawa
, Yuji Mochizuki
:
Fragmentation at sp2 carbon atoms in fragment molecular orbital method. J. Comput. Chem. 41(15): 1416-1420 (2020) - [j8]Ryo Hatada, Koji Okuwaki
, Yuji Mochizuki
, Yuma Handa, Kaori Fukuzawa
, Yuto Komeiji
, Yoshio Okiyama
, Shigenori Tanaka
:
Fragment Molecular Orbital Based Interaction Analyses on COVID-19 Main Protease - Inhibitor N3 Complex (PDB ID: 6LU7). J. Chem. Inf. Model. 60(7): 3593-3602 (2020) - 2019
- [j7]Takaki Tokiwa, Shogo Nakano
, Yuta Yamamoto, Takeshi Ishikawa
, Sohei Ito
, Vladimír Sládek
, Kaori Fukuzawa
, Yuji Mochizuki
, Hiroaki Tokiwa
, Fuminori Misaizu
, Yasuteru Shigeta
:
Development of an Analysis Toolkit, AnalysisFMO, to Visualize Interaction Energies Generated by Fragment Molecular Orbital Calculations. J. Chem. Inf. Model. 59(1): 25-30 (2019) - 2018
- [j6]Takeshi Ishikawa
, Kota Sakakura, Yuji Mochizuki:
RI-MP3 calculations of biomolecules based on the fragment molecular orbital method. J. Comput. Chem. 39(24): 1970-1978 (2018) - 2009
- [j5]Yuto Komeiji
, Takeshi Ishikawa
, Yuji Mochizuki, Hiroshi Yamataka, Tatsuya Nakano:
Fragment Molecular Orbital method-based Molecular Dynamics (FMO-MD) as a simulator for chemical reactions in explicit solvation. J. Comput. Chem. 30(1): 40-50 (2009) - 2008
- [j4]Tatsunori Iwata, Kaori Fukuzawa
, Katsuhisa Nakajima, Sachiko Aida-Hyugaji, Yuji Mochizuki, Hirofumi Watanabe
, Shigenori Tanaka:
Theoretical analysis of binding specificity of influenza viral hemagglutinin to avian and human receptors based on the fragment molecular orbital method. Comput. Biol. Chem. 32(3): 198-211 (2008) - 2007
- [j3]Kaori Fukuzawa
, Yuto Komeiji
, Yuji Mochizuki, Akifumi Kato, Tatsuya Nakano, Shigenori Tanaka:
Intra- and intermolecular interactions between cyclic-AMP receptor protein and DNA: Ab initio fragment molecular orbital study. J. Comput. Chem. 28(13): 2237-2239 (2007) - 2006
- [j2]Kaori Fukuzawa
, Yuto Komeiji
, Yuji Mochizuki, Akifumi Kato, Tatsuya Nakano, Shigenori Tanaka:
Intra- and intermolecular interactions between cyclic-AMP receptor protein and DNA: Ab initio fragment molecular orbital study. J. Comput. Chem. 27(8): 948-960 (2006) - [j1]Shinji Amari, Masahiro Aizawa, Junwei Zhang, Kaori Fukuzawa
, Yuji Mochizuki, Yoshio Iwasawa, Kotoko Nakata, Hiroshi Chuman, Tatsuya Nakano:
VISCANA: Visualized Cluster Analysis of Protein-Ligand Interaction Based on the ab Initio Fragment Molecular Orbital Method for Virtual Ligand Screening. J. Chem. Inf. Model. 46(1): 221-230 (2006)
Conference and Workshop Papers
- 2015
- [c3]Yuji Mochizuki, Yoshifumi Manabe:
A privacy-preserving collaborative filtering protocol considering updates. APSITT 2015: 1-3 - 2011
- [c2]Takeshi Osoekawa, Yuji Mochizuki, Kazuhiro Yokoyama:
Development of QC2AS - A Computer Algebra System for Symbolic Quantum Chemical Computations. ICCSA Workshops 2011: 102-109 - 2010
- [c1]Takeshi Osoekawa, Naoyuki Shinohara, Yuji Mochizuki, Kazuhiro Yokoyama:
Gröbner Basis Technique for Algebraic Formulas in Electron Correlation Theories. ICCSA Workshops 2010: 17-23
Coauthor Index
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last updated on 2024-04-24 23:03 CEST by the dblp team
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