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Tsutsumi Lab
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The lab uses computational chemistry and information science to explore how chemical reactions work.
AboutAbout the lab
Exploring the essence of chemical reactions through computation and information science
The Tsutsumi Lab uses computational chemistry and information science methods, aiming to clarify why and how chemical phenomena occur.
The lab develops methodologies for extracting and understanding the essential information that governs chemical reactions and phenomena from the complex data obtained through computational and experimental chemistry.
Recently, the lab has also been working on computational science for the solution properties of polymers and on building large-scale databases for polymer informatics.
The lab belongs to the Materials Information Theory chair in the Department of Complex Systems Science, Graduate School of Informatics, and conducts research in cooperation with the Yoshida Lab, Higashi Lab, and Matsumoto Lab in the same chair.
Key terms
- Reaction path analysis
- A method of studying chemical reactions by focusing on the minimum-energy path from reactants to products.
- Reaction dynamics analysis
- A method of studying chemical reactions by focusing on the motion of atomic nuclei.
- Dimensionality reduction
- A mathematical science technique that compresses high-dimensional data into fewer dimensions.
- Reaction Space Projector (ReSPer)
- A method that reduces the dimensionality of a reaction path network and draws the energy landscape. Abbreviated as ReSPer.
NewsLab news
View More ↗ResearchResearch themes
The lab uses computational chemistry and information science methods, aiming to clarify why and how chemical reactions and phenomena occur. It develops methodologies for extracting essential information from the complex data obtained through computation and experiments, and applies them. Going forward, it aims to extend this work to polymer chemistry.
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MembersFaculty
The members of the Tsutsumi Lab are faculty. Introductions of student members are in preparation.As of 2026
- Associate ProfessorTakuro Tsutsumi
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Report an errorAbout the images
The top and research theme images are illustrative and were not taken at the lab. They are cropped from Wikimedia Commons images. Cropped CC BY-SA images are provided under the same CC BY-SA license as the original (version shown on each line).
- Top image: “Aurora environment 1600x900” Argonne National Laboratory / Public domain (cropped)
- Reaction analysis with the Reaction Space Projector: “Pleiades supercomputer racks 3” Oleg Alexandrov / CC BY-SA 4.0 (cropped)
- Related lab (Higashi Lab): “Vanillin-3D-molecular-model-engraved-render-CAS-121-33-5” MolGod Scientific / CC BY-SA 4.0 (cropped)
- Related lab (Yoshida Lab): “SARS-CoV-2 Nucleocapsid (N) protein render” Imnulls / CC0 (cropped)
- Related lab (Nagamine Lab): “Satellite image of Czech Republic in September 2003” 作者不詳 / Public domain (cropped)
- Related lab (ALIFE-CORE Lab): “A starling murmuration at Prestwick - geograph.org.uk - 5991171” Walter Baxter / CC BY-SA 2.0 (cropped)
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