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Chemistry (Weinheim an Der Bergstrasse, Germany)
|
April 30, 2021
Synthesis of Difluoroglycine Derivatives from Amines, Difluorocarbene, and CO<sub>2</sub> : Computational Design, Scope, and Applications
Hiroki Hayashi, Hideaki Takano, Hitomi Katsuyama, et al.
RSC Advances
|
February 11, 2026
Reaction yield oscillates over reaction time in first-order chemical reactions
Yu Harabuchi, Tomohiko Yokoyama, Keisuke Katayama, et al.
The Journal of Physical Chemistry. A
|
April 2, 2024
Differentiating the Yield of Chemical Reactions Using Parameters in First-Order Kinetic Equations to Identify Elementary Steps That Control the Reactivity from Complicated Reaction Path Networks
Yu Harabuchi, Tomohiko Yokoyama, Wataru Matsuoka, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
February 21, 2026
Revisiting C4N4 Fluorophore: Theoretical Elucidation of the Origin of Fluorescent Properties of 2,5-Diaminopyrimidines and Strategic Applications to Pd Detection
Miki Kohei, Itsuki Kondo, Go Kawamura, et al.
Journal of Chemical Theory and Computation
|
March 16, 2026
Toward Reaction Vessel Mimicry: Machine Learning-Assisted Automated Exploration of Alkene Polymerization and Its Transferability
Sagar Ghorai, Ruben Staub, Yu Harabuchi, et al.
Journal of Computational Chemistry
|
October 30, 2015
Nontotally symmetric trifurcation of an SN 2 reaction pathway
Yu Harabuchi, Yuriko Ono, Satoshi Maeda, et al.
The Journal of Organic Chemistry
|
November 8, 2019
Fluorescence Enhancement of Aromatic Macrocycles by Lowering Excited Singlet State Energies
Koki Ikemoto, Toshiki Tokuhira, Akari Uetani, et al.
ACS Central Science
|
April 27, 2026
Predicting Enantioselectivity via Kinetic Simulations on Gigantic Reaction Path Networks
Yu Harabuchi, Ruben Staub, Min Gao, et al.
Nature Communications
|
November 21, 2022
A theory-driven synthesis of symmetric and unsymmetric 1,2-bis(diphenylphosphino)ethane analogues via radical difunctionalization of ethylene
Hideaki Takano, Hitomi Katsuyama, Hiroki Hayashi, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 29, 2018
Femtosecond electronic relaxation and real-time vibrational dynamics in 2'-hydroxychalcone
Yoshihiro Yamakita, Nanae Yokoyama, Bing Xue, et al.
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Search research articles
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Showing results (41-50 of 66) with videos related to
Sort By:
Page
of 7
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
April 30, 2021
Synthesis of Difluoroglycine Derivatives from Amines, Difluorocarbene, and CO<sub>2</sub> : Computational Design, Scope, and Applications
Hiroki Hayashi, Hideaki Takano, Hitomi Katsuyama, et al.
RSC Advances
|
February 11, 2026
Reaction yield oscillates over reaction time in first-order chemical reactions
Yu Harabuchi, Tomohiko Yokoyama, Keisuke Katayama, et al.
The Journal of Physical Chemistry. A
|
April 2, 2024
Differentiating the Yield of Chemical Reactions Using Parameters in First-Order Kinetic Equations to Identify Elementary Steps That Control the Reactivity from Complicated Reaction Path Networks
Yu Harabuchi, Tomohiko Yokoyama, Wataru Matsuoka, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
February 21, 2026
Revisiting C4N4 Fluorophore: Theoretical Elucidation of the Origin of Fluorescent Properties of 2,5-Diaminopyrimidines and Strategic Applications to Pd Detection
Miki Kohei, Itsuki Kondo, Go Kawamura, et al.
Journal of Chemical Theory and Computation
|
March 16, 2026
Toward Reaction Vessel Mimicry: Machine Learning-Assisted Automated Exploration of Alkene Polymerization and Its Transferability
Sagar Ghorai, Ruben Staub, Yu Harabuchi, et al.
Journal of Computational Chemistry
|
October 30, 2015
Nontotally symmetric trifurcation of an SN 2 reaction pathway
Yu Harabuchi, Yuriko Ono, Satoshi Maeda, et al.
The Journal of Organic Chemistry
|
November 8, 2019
Fluorescence Enhancement of Aromatic Macrocycles by Lowering Excited Singlet State Energies
Koki Ikemoto, Toshiki Tokuhira, Akari Uetani, et al.
ACS Central Science
|
April 27, 2026
Predicting Enantioselectivity via Kinetic Simulations on Gigantic Reaction Path Networks
Yu Harabuchi, Ruben Staub, Min Gao, et al.
Nature Communications
|
November 21, 2022
A theory-driven synthesis of symmetric and unsymmetric 1,2-bis(diphenylphosphino)ethane analogues via radical difunctionalization of ethylene
Hideaki Takano, Hitomi Katsuyama, Hiroki Hayashi, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 29, 2018
Femtosecond electronic relaxation and real-time vibrational dynamics in 2'-hydroxychalcone
Yoshihiro Yamakita, Nanae Yokoyama, Bing Xue, et al.
Page
of 7