Masataka Nagaoka

24PUBLICATIONS
18CO-AUTHORS
Catalysis and mechanisms of reactionsOrganometallic chemistryPolymerisation mechanismsHuman biophysicsEnergy generation, conversion and storage (excl. chemical and electrical)
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Publications (24)

|Mar 06, 2026
On the Bona Fide Sampling of Reaction Candidates in Red Moon Method by Replica-Exchange Molecular Dynamics Method: REMD-RM Method and Its Efficacy in Polymerization and Cross-Linking Reactions of Polypropylene.

Kentaro Matsumoto, Yuichi Tanaka, Seiryu Umetani

|Mar 04, 2026
Atomistic Simulation of Ion Pair Aggregates of a (Pyridylamido)Hf(IV) Catalyst: Energetic Destabilization and Structural Diversity Induced by Monomer, Chain Transfer Agent, and Growing Polymer Chain.

Kentaro Matsumoto, Masataka Nagaoka

|Jun 07, 2024
Atomistic Simulation of Hf-Pyridyl Amido-Catalyzed Chain Transfer Alkene Polymerization Reaction and Its Machine Learning for Extraction of Essential Descriptors: Effect of Microscopic Steric Hindrance on the Monomer Insertion Process.

Shuhei Kanesato, Katsuhisa Yasoshima, Kentaro Matsumoto

|Mar 15, 2024
Histidine Protonation States Regulate the State Transition from R State Hemoglobin.

Haruka Yotsuya, Miho Tanaka, Yukichi Kitamura

|Sep 01, 2023
Atomistic Chemical Elucidation of the Higher-Rate Reaction Mechanism in Hf-Pyridyl Amido-Catalyzed Copolymerization of Ethene and 1-Octene: Application of Red Moon Simulation with Polymer Propagation Diagrams.

Shuhei Kanesato, Katsuhisa Yasoshima, Nana Misawa

|May 22, 2023
Microscopic Analysis of the Mechanical Stability of an SEI Layer Structure Depending on the FEC Additive Concentration in Na-Ion Batteries: Maximum Appearance in Vickers Hardness at Lower FEC Concentrations.

Amine Bouibes, Nisrine Sakaki, Masataka Nagaoka

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Frequent Collaborators

3 joint publications

Nobuaki Koga

2 joint publications

Soumen Saha

2 joint publications

Manuel F Ruiz-López

2 joint publications

Shinichi Komaba