The mission of ICReDD is the design and discovery of chemical reactions to enable humanity to purposefully craft chemical reactions to any design. We use computational science, information science, and experimental science to develop new methods, new materials, and new applications across all fields where chemical reactions are important.
In particular, we have been developing the “Artificial Force-Induced Reaction” (AFIR) method that allows the exploration of the full chemical reaction network to discover unknown paths to desired products. The method can be applied to a wide range of reactions such as organic synthesis reactions, photoreactions, nanoparticle catalysts, heterogeneous catalysts, and phase transition reactions. The huge amount of data produced by the method needs to be managed by advanced information technology methods such as path enumeration, data mining, and machine learning that help to pinpoint promising reaction pathways. This approach is complemented by experimental chemists from a variety of fields who verify the proposed reactions, develop new experimental methods, and develop the applications.
Here we introduce our recent Research News, and introduce our main Research Topics.
[MANABIYA Manuscript]
Platinum(II) chiral diene catalyst enables enantioselective [4+2] cycloaddition via Pt(II)/Pt(IV) cycle
Latest Research
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Press Release Surpassing the human eye: machine learning image analysis rapidly determines chemical mixture composition
- INOKUMA, Yasuhide
- TAKIGAWA, Ichigaku
- HU, Sheng
- IDE, Yuki
Aug 30, 2023- research-news
- Latest Research
- Press Release
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Dynamic behavior of intermediate adsorbates control activity and selectivity in methanol decomposition on oxide supported catalyst
- GAO, Min
Aug 23, 2023- research-news
- Latest Research
- Press Release
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MANABIYA Manuscript Computationally guided catalyst design for low-temperature methane combustionJul 24, 2023
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- Latest Research
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Reaching new heights: ultrasound-based microfluidic platform enables droplet control with high jumping ability
- NAGATA, Yuuya
Jul 21, 2023- research-news
- Latest Research
- Press Release
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Press Release Virtual exploration of chemical reactions
- TAKAHASHI, Keisuke
- MAEDA, Satoshi
- HARABUCHI, Yu
Jul 11, 2023- research-news
- Latest Research
- Press Release
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Identifying high-grade serous ovarian carcinoma-specific extracellular vesicles by polyketone-coated nanowires
- INOKUMA, Yasuhide
Jul 10, 2023- research-news
- Press Release