Yuji Mochizuki

According to our database, Yuji Mochizuki authored at least 14 papers between 2006 and 2024.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2024

Enhancement of energy decomposition analysis in fragment molecular orbital calculations.

Sota Matsuoka, Kota Sakakura, Yoshinobu Akinaga, Kazuki Akisawa, Koji Okuwaki, Hideo Doi, Yuji Mochizuki

J. Comput. Chem., May, 2024

Size-consistency and orbital-invariance issues revealed by VQE-UCCSD calculations with the FMO scheme.

Kenji Sugisaki, Tatsuya Nakano, Yuji Mochizuki

J. Comput. Chem., 2024

2020

Fragment Molecular Orbital Based Interaction Analyses on COVID-19 Main Protease - Inhibitor N3 Complex (PDB ID: 6LU7).

Ryo Hatada, Koji Okuwaki, Yuji Mochizuki, Yuma Handa, Kaori Fukuzawa, Yuto Komeiji, Yoshio Okiyama, Shigenori Tanaka

J. Chem. Inf. Model., 2020

Fragmentation at sp2 carbon atoms in fragment molecular orbital method.

Yoshinobu Akinaga, Koichiro Kato, Tatsuya Nakano, Kaori Fukuzawa, Yuji Mochizuki

J. Comput. Chem., 2020

2019

Development of an Analysis Toolkit, AnalysisFMO, to Visualize Interaction Energies Generated by Fragment Molecular Orbital Calculations.

Takaki Tokiwa, Shogo Nakano, Yuta Yamamoto, Takeshi Ishikawa, Sohei Ito, Vladimír Sládek, Kaori Fukuzawa, Yuji Mochizuki, Hiroaki Tokiwa, Fuminori Misaizu, Yasuteru Shigeta

J. Chem. Inf. Model., 2019

2018

RI-MP3 calculations of biomolecules based on the fragment molecular orbital method.

Takeshi Ishikawa, Kota Sakakura, Yuji Mochizuki

J. Comput. Chem., 2018

2015

A privacy-preserving collaborative filtering protocol considering updates.

Yuji Mochizuki, Yoshifumi Manabe

Proceedings of the 10th Asia-Pacific Symposium on Information and Telecommunication Technologies, 2015

2011

Development of QC2AS - A Computer Algebra System for Symbolic Quantum Chemical Computations.

Takeshi Osoekawa, Yuji Mochizuki, Kazuhiro Yokoyama

Proceedings of the International Conference on Computational Science and Its Applications, 2011

2010

Gröbner Basis Technique for Algebraic Formulas in Electron Correlation Theories.

Takeshi Osoekawa, Naoyuki Shinohara, Yuji Mochizuki, Kazuhiro Yokoyama

Proceedings of the Prodeedings of the 2010 International Conference on Computational Science and Its Applications, 2010

2009

Fragment Molecular Orbital method-based Molecular Dynamics (FMO-MD) as a simulator for chemical reactions in explicit solvation.

Yuto Komeiji, Takeshi Ishikawa, Yuji Mochizuki, Hiroshi Yamataka, Tatsuya Nakano

J. Comput. Chem., 2009

2008

Theoretical analysis of binding specificity of influenza viral hemagglutinin to avian and human receptors based on the fragment molecular orbital method.

Tatsunori Iwata, Kaori Fukuzawa, Katsuhisa Nakajima, Sachiko Aida-Hyugaji, Yuji Mochizuki, Hirofumi Watanabe, Shigenori Tanaka

Comput. Biol. Chem., 2008

2007

Intra- and intermolecular interactions between cyclic-AMP receptor protein and DNA: Ab <i>initio</i> fragment molecular orbital study.

Kaori Fukuzawa, Yuto Komeiji, Yuji Mochizuki, Akifumi Kato, Tatsuya Nakano, Shigenori Tanaka

J. Comput. Chem., 2007

2006

VISCANA: Visualized Cluster Analysis of Protein-Ligand Interaction Based on the ab Initio Fragment Molecular Orbital Method for Virtual Ligand Screening.

Shinji Amari, Masahiro Aizawa, Junwei Zhang, Kaori Fukuzawa, Yuji Mochizuki, Yoshio Iwasawa, Kotoko Nakata, Hiroshi Chuman, Tatsuya Nakano

J. Chem. Inf. Model., 2006

Intra- and intermolecular interactions between cyclic-AMP receptor protein and DNA: Ab initio fragment molecular orbital study.

Kaori Fukuzawa, Yuto Komeiji, Yuji Mochizuki, Akifumi Kato, Tatsuya Nakano, Shigenori Tanaka

J. Comput. Chem., 2006