Chiduru Watanabe

18PUBLICATIONS
44CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Theoretical quantum chemistryComputational chemistryBiomolecular modelling and design
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Publications (18)

|Sep 25, 2025
A Dual-Target-Based Screening Strategy for Anti-SARS-CoV-2 Active Compounds Enabling the Identification of Macrocyclic Peptide Natural Products: Chloropeptins.

Aoi Kimishima, Terumasa Ikeda, Otowa Takahashi

|Jun 10, 2025
Quantitative Structure-Activity Relationships for Human Galectin-3 Inhibitors: Insights from Quantum Chemical Interaction Energy Terms.

Tomohide Masuda, Chiduru Watanabe, Koichiro Kato

|Dec 02, 2024
Geometry Optimization Using the Frozen Domain and Partial Dimer Approaches in the Fragment Molecular Orbital Method: Implementation, Benchmark, and Applications to Protein Ligand-Binding Sites.

Koji Okuwaki, Naoki Watanabe, Koichiro Kato

|Oct 24, 2024
Quantum chemical calculation dataset for representative protein folds by the fragment molecular orbital method.

Daisuke Takaya, Shu Ohno, Toma Miyagishi

|Sep 05, 2024
FMOe: Preprocessing and Visualizing Package of the Fragment Molecular Orbital Method for Molecular Operating Environment and Its Applications in Covalent Ligand and Metalloprotein Analyses.

Hirotomo Moriwaki, Yusuke Kawashima, Chiduru Watanabe

|Apr 06, 2023
Quantum Chemical Interaction Analysis between SARS-CoV-2 Main Protease and Ensitrelvir Compared with Its Initial Screening Hit.

Chiduru Watanabe, Shigenori Tanaka, Yoshio Okiyama

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Frequent Collaborators

14 joint publications

Teruki Honma

10 joint publications

Kaori Fukuzawa

7 joint publications

Shigenori Tanaka

6 joint publications

Yoshio Okiyama